# ##################################################################################################
#  Disclaimer                                                                                      #
#  This file is a python3 translation of AutoDockTools (v.1.5.7)                                   #
#  Modifications made by Valdes-Tresanco MS (https://github.com/Valdes-Tresanco-MS)                #
#  Tested by Valdes-Tresanco-MS and Valdes-Tresanco ME                                             #
#  There is no guarantee that it works like the original distribution,                             #
#  but feel free to tell us if you get any difference to correct the code.                         #
#                                                                                                  #
#  Please use this cite the original reference.                                                    #
#  If you think my work helps you, just keep this note intact on your program.                     #
#                                                                                                  #
#  Modification date: 4/7/20 5:48                                                                  #
#                                                                                                  #
# ##################################################################################################

all_nuc94_dat = {
    "DT5": {"H71": {'torsion': 60.0, 'tree': 'E', 'NC': 15, 'NB': 17, 'NA': 18, 'I': 19, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.077, 'type': 'HC'},
            "C5": {'torsion': 177.3, 'tree': 'B', 'NC': 12, 'NB': 14, 'NA': 15, 'I': 17, 'angle': 121.22, 'blen': 1.34,
                   'charge': 0.0025, 'type': 'CM'},
            "C6": {'torsion': 81.59, 'tree': 'B', 'NC': 11, 'NB': 12, 'NA': 14, 'I': 15, 'angle': 123.04, 'blen': 1.37,
                   'charge': -0.2209, 'type': 'CM'},
            "C7": {'torsion': 180.0, 'tree': '3', 'NC': 14, 'NB': 15, 'NA': 17, 'I': 18, 'angle': 121.63, 'blen': 1.5,
                   'charge': -0.2269, 'type': 'CT'},
            "H6": {'torsion': 0.0, 'tree': 'E', 'NC': 12, 'NB': 14, 'NA': 15, 'I': 16, 'angle': 120.0, 'blen': 1.08,
                   'charge': 0.2607, 'type': 'H4'},
            "O3'": {'torsion': -203.47, 'tree': 'M', 'NC': 6, 'NB': 9, 'NA': 28, 'I': 33, 'angle': 116.52, 'blen': 1.42,
                    'charge': -0.5232, 'type': 'OS'},
            "C2": {'torsion': 0.0, 'tree': 'S', 'NC': 17, 'NB': 22, 'NA': 24, 'I': 26, 'angle': 126.46, 'blen': 1.38,
                   'charge': 0.5677, 'type': 'C'},
            "N3": {'torsion': 0.0, 'tree': 'B', 'NC': 15, 'NB': 17, 'NA': 22, 'I': 24, 'angle': 114.07, 'blen': 1.38,
                   'charge': -0.434, 'type': 'NA'},
            "C2'": {'torsion': -86.3, 'tree': 'B', 'NC': 6, 'NB': 9, 'NA': 28, 'I': 30, 'angle': 102.8, 'blen': 1.53,
                    'charge': -0.0854, 'type': 'CT'},
            "H2'1": {'torsion': 120.0, 'tree': 'E', 'NC': 9, 'NB': 28, 'NA': 30, 'I': 31, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0718, 'type': 'HC'},
            "H2'2": {'torsion': 240.0, 'tree': 'E', 'NC': 9, 'NB': 28, 'NA': 30, 'I': 32, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0718, 'type': 'HC'},
            "O4'": {'torsion': -86.31, 'tree': 'S', 'NC': 5, 'NB': 6, 'NA': 9, 'I': 11, 'angle': 108.86, 'blen': 1.46,
                    'charge': -0.3691, 'type': 'OS'},
            "INTX,KFORM": ['INT', '1'],
            "O5'": {'torsion': -98.89, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 101.43, 'blen': 0.96,
                    'charge': -0.6318, 'type': 'OH'},
            "O4": {'torsion': 180.0, 'tree': 'E', 'NC': 15, 'NB': 17, 'NA': 22, 'I': 23, 'angle': 125.35, 'blen': 1.23,
                   'charge': -0.5563, 'type': 'O'},
            "H3": {'torsion': 180.0, 'tree': 'E', 'NC': 17, 'NB': 22, 'NA': 24, 'I': 25, 'angle': 116.77, 'blen': 1.09,
                   'charge': 0.342, 'type': 'H'},
            "IFIXC,IOMIT,ISYMDU,IPOS": ['CORRECT', 'NOMIT', 'DU', 'BEG'],
            "C4": {'torsion': 0.0, 'tree': 'B', 'NC': 14, 'NB': 15, 'NA': 17, 'I': 22, 'angle': 120.78, 'blen': 1.44,
                   'charge': 0.5194, 'type': 'C'},
            "H73": {'torsion': 300.0, 'tree': 'E', 'NC': 15, 'NB': 17, 'NA': 18, 'I': 21, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.077, 'type': 'HC'},
            "H3'": {'torsion': 30.0, 'tree': 'E', 'NC': 6, 'NB': 9, 'NA': 28, 'I': 29, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.0985, 'type': 'H1'},
            "NAMRES": "D-THYMINE - with 5' - OH end group and 3' - O(minus)",
            "H4'": {'torsion': -200.0, 'tree': 'E', 'NC': 5, 'NB': 6, 'NA': 9, 'I': 10, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.1176, 'type': 'H1'},
            "H1'": {'torsion': -240.0, 'tree': 'E', 'NC': 9, 'NB': 11, 'NA': 12, 'I': 13, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.1804, 'type': 'H2'},
            "O2": {'torsion': 180.0, 'tree': 'E', 'NC': 22, 'NB': 24, 'NA': 26, 'I': 27, 'angle': 121.7, 'blen': 1.22,
                   'charge': -0.5881, 'type': 'O'},
            "atNameList": ['H5T', "O5'", "C5'", "H5'1", "H5'2", "C4'", "H4'", "O4'", "C1'", "H1'", 'N1', 'C6', 'H6',
                           'C5', 'C7', 'H71', 'H72', 'H73', 'C4', 'O4', 'N3', 'H3', 'C2', 'O2', "C3'", "H3'", "C2'",
                           "H2'1", "H2'2", "O3'"],
            "DUMM": [['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.00', '0.00', '0.00', '0.0000'],
                     ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.00', '0.00', '0.00', '0.0000'],
                     ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.00', '90.00', '0.00', '0.0000']],
            "N1": {'torsion': -127.7, 'tree': 'S', 'NC': 9, 'NB': 11, 'NA': 12, 'I': 14, 'angle': 109.59, 'blen': 1.53,
                   'charge': -0.0239, 'type': 'N*'},
            "H5'2": {'torsion': -60.0, 'tree': 'E', 'NC': 4, 'NB': 5, 'NA': 6, 'I': 8, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0754, 'type': 'H1'},
            "H5'1": {'torsion': 60.0, 'tree': 'E', 'NC': 4, 'NB': 5, 'NA': 6, 'I': 7, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0754, 'type': 'H1'},
            "C4'": {'torsion': -180.0, 'tree': 'M', 'NC': 4, 'NB': 5, 'NA': 6, 'I': 9, 'angle': 110.0, 'blen': 1.52,
                    'charge': 0.1629, 'type': 'CT'},
            "H72": {'torsion': 180.0, 'tree': 'E', 'NC': 15, 'NB': 17, 'NA': 18, 'I': 20, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.077, 'type': 'HC'},
            "H5T": {'torsion': 180.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 120.0, 'blen': 1.0,
                    'charge': 0.4422, 'type': 'HO'},
            "C5'": {'torsion': -39.22, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 5, 'I': 6, 'angle': 119.0, 'blen': 1.44,
                    'charge': -0.0069, 'type': 'CT'},
            "C1'": {'torsion': 105.6, 'tree': 'B', 'NC': 6, 'NB': 9, 'NA': 11, 'I': 12, 'angle': 110.04, 'blen': 1.42,
                    'charge': 0.068, 'type': 'CT'},
            "C3'": {'torsion': -329.11, 'tree': 'M', 'NC': 5, 'NB': 6, 'NA': 9, 'I': 28, 'angle': 115.78, 'blen': 1.53,
                    'charge': 0.0713, 'type': 'CT'},
            "loopList": [["C1'", "C2'"], ['C2', 'N1']],
            "CUT": ['0.0'],
            "impropTors": [['C6', 'C2', 'N1', "C1'"], ['C4', 'C6', 'C5', 'C7'], ['N1', 'N3', 'C2', 'O2'],
                           ['C5', 'N3', 'C4', 'O4'], ['C2', 'C4', 'N3', 'H3'], ['N1', 'C5', 'C6', 'H6']],
            },
    "DT3": {"H71": {'torsion': 60.0, 'tree': 'E', 'NC': 17, 'NB': 19, 'NA': 20, 'I': 21, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.077, 'type': 'HC'},
            "C5": {'torsion': 177.3, 'tree': 'B', 'NC': 14, 'NB': 16, 'NA': 17, 'I': 19, 'angle': 121.22, 'blen': 1.34,
                   'charge': 0.0025, 'type': 'CM'},
            "C6": {'torsion': 81.59, 'tree': 'B', 'NC': 13, 'NB': 14, 'NA': 16, 'I': 17, 'angle': 123.04, 'blen': 1.37,
                   'charge': -0.2209, 'type': 'CM'},
            "C7": {'torsion': 180.0, 'tree': '3', 'NC': 16, 'NB': 17, 'NA': 19, 'I': 20, 'angle': 121.63, 'blen': 1.5,
                   'charge': -0.2269, 'type': 'CT'},
            "H6": {'torsion': 0.0, 'tree': 'E', 'NC': 14, 'NB': 16, 'NA': 17, 'I': 18, 'angle': 120.0, 'blen': 1.08,
                   'charge': 0.2607, 'type': 'H4'},
            "O3'": {'torsion': -203.47, 'tree': 'M', 'NC': 8, 'NB': 11, 'NA': 30, 'I': 35, 'angle': 116.52,
                    'blen': 1.42, 'charge': -0.6549, 'type': 'OH'},
            "C2": {'torsion': 0.0, 'tree': 'S', 'NC': 19, 'NB': 24, 'NA': 26, 'I': 28, 'angle': 126.46, 'blen': 1.38,
                   'charge': 0.5677, 'type': 'C'},
            "N3": {'torsion': 0.0, 'tree': 'B', 'NC': 17, 'NB': 19, 'NA': 24, 'I': 26, 'angle': 114.07, 'blen': 1.38,
                   'charge': -0.434, 'type': 'NA'},
            "C2'": {'torsion': -86.3, 'tree': 'B', 'NC': 8, 'NB': 11, 'NA': 30, 'I': 32, 'angle': 102.8, 'blen': 1.53,
                    'charge': -0.0854, 'type': 'CT'},
            "H2'1": {'torsion': 120.0, 'tree': 'E', 'NC': 11, 'NB': 30, 'NA': 32, 'I': 33, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0718, 'type': 'HC'},
            "H2'2": {'torsion': 240.0, 'tree': 'E', 'NC': 11, 'NB': 30, 'NA': 32, 'I': 34, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0718, 'type': 'HC'},
            "O4'": {'torsion': -86.31, 'tree': 'S', 'NC': 7, 'NB': 8, 'NA': 11, 'I': 13, 'angle': 108.86, 'blen': 1.46,
                    'charge': -0.3691, 'type': 'OS'},
            "INTX,KFORM": ['INT', '1'],
            "O5'": {'torsion': -98.89, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 7, 'angle': 101.43, 'blen': 1.6,
                    'charge': -0.4954, 'type': 'OS'},
            "O4": {'torsion': 180.0, 'tree': 'E', 'NC': 17, 'NB': 19, 'NA': 24, 'I': 25, 'angle': 125.35, 'blen': 1.23,
                   'charge': -0.5563, 'type': 'O'},
            "H3T": {'torsion': 180.0, 'tree': 'M', 'NC': 11, 'NB': 30, 'NA': 35, 'I': 36, 'angle': 114.97, 'blen': 0.96,
                    'charge': 0.4396, 'type': 'HO'},
            "H3": {'torsion': 180.0, 'tree': 'E', 'NC': 19, 'NB': 24, 'NA': 26, 'I': 27, 'angle': 116.77, 'blen': 1.09,
                   'charge': 0.342, 'type': 'H'},
            "IFIXC,IOMIT,ISYMDU,IPOS": ['CORRECT', 'OMIT', 'DU', 'BEG'],
            "H72": {'torsion': 180.0, 'tree': 'E', 'NC': 17, 'NB': 19, 'NA': 20, 'I': 22, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.077, 'type': 'HC'},
            "H73": {'torsion': 300.0, 'tree': 'E', 'NC': 17, 'NB': 19, 'NA': 20, 'I': 23, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.077, 'type': 'HC'},
            "H3'": {'torsion': 30.0, 'tree': 'E', 'NC': 8, 'NB': 11, 'NA': 30, 'I': 31, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.0985, 'type': 'H1'},
            "NAMRES": "D-THYMINE - with 5' - phosphate group and 3' - OH group",
            "H4'": {'torsion': -200.0, 'tree': 'E', 'NC': 7, 'NB': 8, 'NA': 11, 'I': 12, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.1176, 'type': 'H1'},
            "H1'": {'torsion': -240.0, 'tree': 'E', 'NC': 11, 'NB': 13, 'NA': 14, 'I': 15, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.1804, 'type': 'H2'},
            "O2": {'torsion': 180.0, 'tree': 'E', 'NC': 24, 'NB': 26, 'NA': 28, 'I': 29, 'angle': 121.7, 'blen': 1.22,
                   'charge': -0.5881, 'type': 'O'},
            "atNameList": ['P', 'O1P', 'O2P', "O5'", "C5'", "H5'1", "H5'2", "C4'", "H4'", "O4'", "C1'", "H1'", 'N1',
                           'C6', 'H6', 'C5', 'C7', 'H71', 'H72', 'H73', 'C4', 'O4', 'N3', 'H3', 'C2', 'O2', "C3'",
                           "H3'", "C2'", "H2'1", "H2'2", "O3'", 'H3T'],
            "DUMM": [['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.00', '0.00', '0.00', '0.0000'],
                     ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.00', '0.00', '0.00', '0.0000'],
                     ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.00', '90.00', '0.00', '0.0000']],
            "N1": {'torsion': -127.7, 'tree': 'S', 'NC': 11, 'NB': 13, 'NA': 14, 'I': 16, 'angle': 109.59, 'blen': 1.53,
                   'charge': -0.0239, 'type': 'N*'},
            "H5'2": {'torsion': -60.0, 'tree': 'E', 'NC': 4, 'NB': 7, 'NA': 8, 'I': 10, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0754, 'type': 'H1'},
            "H5'1": {'torsion': 60.0, 'tree': 'E', 'NC': 4, 'NB': 7, 'NA': 8, 'I': 9, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0754, 'type': 'H1'},
            "C4'": {'torsion': 180.0, 'tree': 'M', 'NC': 4, 'NB': 7, 'NA': 8, 'I': 11, 'angle': 110.0, 'blen': 1.52,
                    'charge': 0.1629, 'type': 'CT'},
            "P": {'torsion': 200.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 119.04, 'blen': 1.6,
                  'charge': 1.1659, 'type': 'P'},
            "C5'": {'torsion': -39.22, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 7, 'I': 8, 'angle': 119.0, 'blen': 1.44,
                    'charge': -0.0069, 'type': 'CT'},
            "C4": {'torsion': 0.0, 'tree': 'B', 'NC': 16, 'NB': 17, 'NA': 19, 'I': 24, 'angle': 120.78, 'blen': 1.44,
                   'charge': 0.5194, 'type': 'C'},
            "O2P": {'torsion': 20.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 6, 'angle': 109.58, 'blen': 1.48,
                    'charge': -0.7761, 'type': 'O2'},
            "C1'": {'torsion': 105.6, 'tree': 'B', 'NC': 8, 'NB': 11, 'NA': 13, 'I': 14, 'angle': 110.04, 'blen': 1.42,
                    'charge': 0.068, 'type': 'CT'},
            "C3'": {'torsion': -329.11, 'tree': 'M', 'NC': 7, 'NB': 8, 'NA': 11, 'I': 30, 'angle': 115.78, 'blen': 1.53,
                    'charge': 0.0713, 'type': 'CT'},
            "O1P": {'torsion': 150.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 109.61, 'blen': 1.48,
                    'charge': -0.7761, 'type': 'O2'},
            "loopList": [["C1'", "C2'"], ['C2', 'N1']],
            "CUT": ['0.0'],
            "impropTors": [['C6', 'C2', 'N1', "C1'"], ['C4', 'C6', 'C5', 'C7'], ['N1', 'N3', 'C2', 'O2'],
                           ['C5', 'N3', 'C4', 'O4'], ['C2', 'C4', 'N3', 'H3'], ['N1', 'C5', 'C6', 'H6']],
            },
    "RC": {"C4": {'torsion': 0.0, 'tree': 'B', 'NC': 16, 'NB': 17, 'NA': 19, 'I': 21, 'angle': 116.9, 'blen': 1.43,
                  'charge': 0.8185, 'type': 'CA'},
           "C5": {'torsion': 180.0, 'tree': 'B', 'NC': 14, 'NB': 16, 'NA': 17, 'I': 19, 'angle': 121.0, 'blen': 1.36,
                  'charge': -0.5215, 'type': 'CM'},
           "C6": {'torsion': 81.59, 'tree': 'B', 'NC': 13, 'NB': 14, 'NA': 16, 'I': 17, 'angle': 121.1, 'blen': 1.36,
                  'charge': 0.0053, 'type': 'CM'},
           "O3'": {'torsion': -203.47, 'tree': 'M', 'NC': 8, 'NB': 11, 'NA': 28, 'I': 34, 'angle': 116.52, 'blen': 1.42,
                   'charge': -0.5246, 'type': 'OS'},
           "H6": {'torsion': 0.0, 'tree': 'E', 'NC': 14, 'NB': 16, 'NA': 17, 'I': 18, 'angle': 120.0, 'blen': 1.08,
                  'charge': 0.1958, 'type': 'H4'},
           "O2'": {'torsion': 240.0, 'tree': 'S', 'NC': 11, 'NB': 28, 'NA': 30, 'I': 32, 'angle': 109.5, 'blen': 1.43,
                   'charge': -0.6139, 'type': 'OH'},
           "C2": {'torsion': 0.0, 'tree': 'S', 'NC': 19, 'NB': 21, 'NA': 25, 'I': 26, 'angle': 120.5, 'blen': 1.36,
                  'charge': 0.7538, 'type': 'C'},
           "H41": {'torsion': 180.0, 'tree': 'E', 'NC': 19, 'NB': 21, 'NA': 22, 'I': 23, 'angle': 117.7, 'blen': 1.01,
                   'charge': 0.4234, 'type': 'H'},
           "H42": {'torsion': 0.0, 'tree': 'E', 'NC': 19, 'NB': 21, 'NA': 22, 'I': 24, 'angle': 120.27, 'blen': 1.01,
                   'charge': 0.4234, 'type': 'H'},
           "O4'": {'torsion': -86.31, 'tree': 'S', 'NC': 7, 'NB': 8, 'NA': 11, 'I': 13, 'angle': 108.86, 'blen': 1.46,
                   'charge': -0.3548, 'type': 'OS'},
           "INTX,KFORM": ['INT', '1'],
           "O5'": {'torsion': -98.89, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 7, 'angle': 101.43, 'blen': 1.6,
                   'charge': -0.4989, 'type': 'OS'},
           "N3": {'torsion': 0.0, 'tree': 'S', 'NC': 17, 'NB': 19, 'NA': 21, 'I': 25, 'angle': 121.7, 'blen': 1.33,
                  'charge': -0.7584, 'type': 'NC'},
           "IFIXC,IOMIT,ISYMDU,IPOS": ['CORRECT', 'OMIT', 'DU', 'BEG'],
           "loopList": [["C1'", "C2'"], ['C2', 'N1']],
           "N4": {'torsion': 180.0, 'tree': 'B', 'NC': 17, 'NB': 19, 'NA': 21, 'I': 22, 'angle': 120.1, 'blen': 1.32,
                  'charge': -0.953, 'type': 'N2'},
           "NAMRES": "R-CYTOSINE - with 5' - phosphate group and 3' - O(minus) group",
           "HO'2": {'torsion': 180.0, 'tree': 'E', 'NC': 28, 'NB': 30, 'NA': 32, 'I': 33, 'angle': 107.0, 'blen': 0.96,
                    'charge': 0.4186, 'type': 'HO'},
           "H4'": {'torsion': -200.0, 'tree': 'E', 'NC': 7, 'NB': 8, 'NA': 11, 'I': 12, 'angle': 109.5, 'blen': 1.09,
                   'charge': 0.1174, 'type': 'H1'},
           "H1'": {'torsion': -240.0, 'tree': 'E', 'NC': 11, 'NB': 13, 'NA': 14, 'I': 15, 'angle': 109.5, 'blen': 1.09,
                   'charge': 0.2029, 'type': 'H2'},
           "O2": {'torsion': 180.0, 'tree': 'E', 'NC': 21, 'NB': 25, 'NA': 26, 'I': 27, 'angle': 122.4, 'blen': 1.24,
                  'charge': -0.6252, 'type': 'O'},
           "atNameList": ['P', 'O1P', 'O2P', "O5'", "C5'", "H5'1", "H5'2", "C4'", "H4'", "O4'", "C1'", "H1'", 'N1',
                          'C6', 'H6', 'C5', 'H5', 'C4', 'N4', 'H41', 'H42', 'N3', 'C2', 'O2', "C3'", "H3'", "C2'",
                          "H2'1", "O2'", "HO'2", "O3'"],
           "DUMM": [['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.00', '0.00', '0.00', '0.0000'],
                    ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.00', '0.00', '0.00', '0.0000'],
                    ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.00', '90.00', '0.00', '0.0000']],
           "H2'1": {'torsion': 120.0, 'tree': 'E', 'NC': 11, 'NB': 28, 'NA': 30, 'I': 31, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.0972, 'type': 'H1'},
           "N1": {'torsion': -127.7, 'tree': 'S', 'NC': 11, 'NB': 13, 'NA': 14, 'I': 16, 'angle': 108.1, 'blen': 1.49,
                  'charge': -0.0484, 'type': 'N*'},
           "C2'": {'torsion': -86.3, 'tree': 'B', 'NC': 8, 'NB': 11, 'NA': 28, 'I': 30, 'angle': 102.8, 'blen': 1.53,
                   'charge': 0.067, 'type': 'CT'},
           "H5'2": {'torsion': -60.0, 'tree': 'E', 'NC': 4, 'NB': 7, 'NA': 8, 'I': 10, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.0679, 'type': 'H1'},
           "H5'1": {'torsion': 60.0, 'tree': 'E', 'NC': 4, 'NB': 7, 'NA': 8, 'I': 9, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.0679, 'type': 'H1'},
           "H3'": {'torsion': 30.0, 'tree': 'E', 'NC': 8, 'NB': 11, 'NA': 28, 'I': 29, 'angle': 109.5, 'blen': 1.09,
                   'charge': 0.0615, 'type': 'H1'},
           "C4'": {'torsion': 180.0, 'tree': 'M', 'NC': 4, 'NB': 7, 'NA': 8, 'I': 11, 'angle': 110.0, 'blen': 1.52,
                   'charge': 0.1065, 'type': 'CT'},
           "P": {'torsion': 200.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 119.04, 'blen': 1.6,
                 'charge': 1.1662, 'type': 'P'},
           "C5'": {'torsion': -39.22, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 7, 'I': 8, 'angle': 119.0, 'blen': 1.44,
                   'charge': 0.0558, 'type': 'CT'},
           "O2P": {'torsion': 20.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 6, 'angle': 109.58, 'blen': 1.48,
                   'charge': -0.776, 'type': 'O2'},
           "C1'": {'torsion': 105.6, 'tree': 'B', 'NC': 8, 'NB': 11, 'NA': 13, 'I': 14, 'angle': 110.04, 'blen': 1.42,
                   'charge': 0.0066, 'type': 'CT'},
           "C3'": {'torsion': -329.11, 'tree': 'M', 'NC': 7, 'NB': 8, 'NA': 11, 'I': 28, 'angle': 115.78, 'blen': 1.53,
                   'charge': 0.2022, 'type': 'CT'},
           "H5": {'torsion': 180.0, 'tree': 'E', 'NC': 16, 'NB': 17, 'NA': 19, 'I': 20, 'angle': 120.0, 'blen': 1.09,
                  'charge': 0.1928, 'type': 'HA'},
           "O1P": {'torsion': 150.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 109.61, 'blen': 1.48,
                   'charge': -0.776, 'type': 'O2'},
           "CUT": ['0.0'],
           "impropTors": [['C6', 'C2', 'N1', "C1'"], ['N1', 'N3', 'C2', 'O2'], ['C4', 'H41', 'N4', 'H42'],
                          ['N1', 'C5', 'C6', 'H6'], ['C6', 'C4', 'C5', 'H5'], ['N3', 'C5', 'C4', 'N4']],
           },
    "RA": {"H2": {'torsion': 180.0, 'tree': 'E', 'NC': 21, 'NB': 25, 'NA': 26, 'I': 27, 'angle': 120.0, 'blen': 1.08,
                  'charge': 0.0473, 'type': 'H5'},
           "C5": {'torsion': 0.0, 'tree': 'S', 'NC': 16, 'NB': 17, 'NA': 19, 'I': 20, 'angle': 104.0, 'blen': 1.39,
                  'charge': 0.0515, 'type': 'CB'},
           "C6": {'torsion': 180.0, 'tree': 'B', 'NC': 17, 'NB': 19, 'NA': 20, 'I': 21, 'angle': 132.42, 'blen': 1.4,
                  'charge': 0.7009, 'type': 'CA'},
           "O3'": {'torsion': -203.47, 'tree': 'M', 'NC': 8, 'NB': 11, 'NA': 30, 'I': 36, 'angle': 116.52, 'blen': 1.42,
                   'charge': -0.5246, 'type': 'OS'},
           "H62": {'torsion': 0.0, 'tree': 'E', 'NC': 20, 'NB': 21, 'NA': 22, 'I': 24, 'angle': 120.0, 'blen': 1.01,
                   'charge': 0.4115, 'type': 'H'},
           "O2'": {'torsion': 240.0, 'tree': 'S', 'NC': 11, 'NB': 30, 'NA': 32, 'I': 34, 'angle': 109.5, 'blen': 1.43,
                   'charge': -0.6139, 'type': 'OH'},
           "C2": {'torsion': 0.0, 'tree': 'B', 'NC': 20, 'NB': 21, 'NA': 25, 'I': 26, 'angle': 118.8, 'blen': 1.33,
                  'charge': 0.5875, 'type': 'CQ'},
           "H61": {'torsion': 180.0, 'tree': 'E', 'NC': 20, 'NB': 21, 'NA': 22, 'I': 23, 'angle': 120.0, 'blen': 1.01,
                   'charge': 0.4115, 'type': 'H'},
           "P": {'torsion': 200.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 119.04, 'blen': 1.6,
                 'charge': 1.1662, 'type': 'P'},
           "H2'1": {'torsion': 120.0, 'tree': 'E', 'NC': 11, 'NB': 30, 'NA': 32, 'I': 33, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.0972, 'type': 'H1'},
           "C8": {'torsion': 81.59, 'tree': 'B', 'NC': 13, 'NB': 14, 'NA': 16, 'I': 17, 'angle': 131.2, 'blen': 1.37,
                  'charge': 0.2006, 'type': 'CK'},
           "O4'": {'torsion': -86.31, 'tree': 'S', 'NC': 7, 'NB': 8, 'NA': 11, 'I': 13, 'angle': 108.86, 'blen': 1.46,
                   'charge': -0.3548, 'type': 'OS'},
           "INTX,KFORM": ['INT', '1'],
           "O5'": {'torsion': -98.89, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 7, 'angle': 101.43, 'blen': 1.6,
                   'charge': -0.4989, 'type': 'OS'},
           "N7": {'torsion': 177.0, 'tree': 'S', 'NC': 14, 'NB': 16, 'NA': 17, 'I': 19, 'angle': 113.93, 'blen': 1.3,
                  'charge': -0.6073, 'type': 'NB'},
           "IFIXC,IOMIT,ISYMDU,IPOS": ['CORRECT', 'OMIT', 'DU', 'BEG'],
           "C4": {'torsion': 0.0, 'tree': 'E', 'NC': 25, 'NB': 26, 'NA': 28, 'I': 29, 'angle': 110.8, 'blen': 1.35,
                  'charge': 0.3053, 'type': 'CB'},
           "loopList": [["C1'", "C2'"], ['C4', 'C5'], ['C4', 'N9']],
           "H3'": {'torsion': 30.0, 'tree': 'E', 'NC': 8, 'NB': 11, 'NA': 30, 'I': 31, 'angle': 109.5, 'blen': 1.09,
                   'charge': 0.0615, 'type': 'H1'},
           "NAMRES": "R-ADENOSINE - with 5' - phosphate group and 3' - O(minus) group",
           "HO'2": {'torsion': 180.0, 'tree': 'E', 'NC': 30, 'NB': 32, 'NA': 34, 'I': 35, 'angle': 107.0, 'blen': 0.96,
                    'charge': 0.4186, 'type': 'HO'},
           "H8": {'torsion': 0.0, 'tree': 'E', 'NC': 14, 'NB': 16, 'NA': 17, 'I': 18, 'angle': 120.0, 'blen': 1.08,
                  'charge': 0.1553, 'type': 'H5'},
           "H4'": {'torsion': -200.0, 'tree': 'E', 'NC': 7, 'NB': 8, 'NA': 11, 'I': 12, 'angle': 109.5, 'blen': 1.09,
                   'charge': 0.1174, 'type': 'H1'},
           "H1'": {'torsion': -240.0, 'tree': 'E', 'NC': 11, 'NB': 13, 'NA': 14, 'I': 15, 'angle': 109.5, 'blen': 1.09,
                   'charge': 0.2007, 'type': 'H2'},
           "N6": {'torsion': 0.0, 'tree': 'B', 'NC': 19, 'NB': 20, 'NA': 21, 'I': 22, 'angle': 123.5, 'blen': 1.34,
                  'charge': -0.9019, 'type': 'N2'},
           "atNameList": ['P', 'O1P', 'O2P', "O5'", "C5'", "H5'1", "H5'2", "C4'", "H4'", "O4'", "C1'", "H1'", 'N9',
                          'C8', 'H8', 'N7', 'C5', 'C6', 'N6', 'H61', 'H62', 'N1', 'C2', 'H2', 'N3', 'C4', "C3'", "H3'",
                          "C2'", "H2'1", "O2'", "HO'2", "O3'"],
           "DUMM": [['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.00', '0.00', '0.00', '0.0000'],
                    ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.00', '0.00', '0.00', '0.0000'],
                    ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.00', '90.00', '0.00', '0.0000']],
           "N1": {'torsion': 180.0, 'tree': 'S', 'NC': 19, 'NB': 20, 'NA': 21, 'I': 25, 'angle': 117.43, 'blen': 1.34,
                  'charge': -0.7615, 'type': 'NC'},
           "C2'": {'torsion': -86.3, 'tree': 'B', 'NC': 8, 'NB': 11, 'NA': 30, 'I': 32, 'angle': 102.8, 'blen': 1.53,
                   'charge': 0.067, 'type': 'CT'},
           "H5'2": {'torsion': -60.0, 'tree': 'E', 'NC': 4, 'NB': 7, 'NA': 8, 'I': 10, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.0679, 'type': 'H1'},
           "H5'1": {'torsion': 60.0, 'tree': 'E', 'NC': 4, 'NB': 7, 'NA': 8, 'I': 9, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.0679, 'type': 'H1'},
           "C4'": {'torsion': 180.0, 'tree': 'M', 'NC': 4, 'NB': 7, 'NA': 8, 'I': 11, 'angle': 110.0, 'blen': 1.52,
                   'charge': 0.1065, 'type': 'CT'},
           "N9": {'torsion': -127.7, 'tree': 'S', 'NC': 11, 'NB': 13, 'NA': 14, 'I': 16, 'angle': 109.59, 'blen': 1.52,
                  'charge': -0.0251, 'type': 'N*'},
           "C5'": {'torsion': -39.22, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 7, 'I': 8, 'angle': 119.0, 'blen': 1.44,
                   'charge': 0.0558, 'type': 'CT'},
           "O2P": {'torsion': 20.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 6, 'angle': 109.58, 'blen': 1.48,
                   'charge': -0.776, 'type': 'O2'},
           "C1'": {'torsion': 105.6, 'tree': 'B', 'NC': 8, 'NB': 11, 'NA': 13, 'I': 14, 'angle': 110.04, 'blen': 1.42,
                   'charge': 0.0394, 'type': 'CT'},
           "C3'": {'torsion': -329.11, 'tree': 'M', 'NC': 7, 'NB': 8, 'NA': 11, 'I': 30, 'angle': 115.78, 'blen': 1.53,
                   'charge': 0.2022, 'type': 'CT'},
           "N3": {'torsion': 0.0, 'tree': 'S', 'NC': 21, 'NB': 25, 'NA': 26, 'I': 28, 'angle': 129.17, 'blen': 1.32,
                  'charge': -0.6997, 'type': 'NC'},
           "O1P": {'torsion': 150.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 109.61, 'blen': 1.48,
                   'charge': -0.776, 'type': 'O2'},
           "CUT": ['0.0'],
           "impropTors": [['C8', 'C4', 'N9', "C1'"], ['C6', 'H61', 'N6', 'H62'], ['N7', 'N9', 'C8', 'H8'],
                          ['N1', 'N3', 'C2', 'H2'], ['C5', 'N1', 'C6', 'N6']],
           },
    "RG": {"C4": {'torsion': 0.0, 'tree': 'E', 'NC': 23, 'NB': 25, 'NA': 29, 'I': 30, 'angle': 112.2, 'blen': 1.36,
                  'charge': 0.1222, 'type': 'CB'},
           "C5": {'torsion': 0.0, 'tree': 'S', 'NC': 16, 'NB': 17, 'NA': 19, 'I': 20, 'angle': 103.9, 'blen': 1.39,
                  'charge': 0.1744, 'type': 'CB'},
           "C6": {'torsion': 180.0, 'tree': 'B', 'NC': 17, 'NB': 19, 'NA': 20, 'I': 21, 'angle': 130.4, 'blen': 1.42,
                  'charge': 0.477, 'type': 'C'},
           "O3'": {'torsion': -203.47, 'tree': 'M', 'NC': 8, 'NB': 11, 'NA': 31, 'I': 37, 'angle': 116.52, 'blen': 1.42,
                   'charge': -0.5246, 'type': 'OS'},
           "O2'": {'torsion': 240.0, 'tree': 'S', 'NC': 11, 'NB': 31, 'NA': 33, 'I': 35, 'angle': 109.5, 'blen': 1.43,
                   'charge': -0.6139, 'type': 'OH'},
           "impropTors": [['C8', 'C4', 'N9', "C1'"], ['C5', 'N1', 'C6', 'O6'], ['C6', 'C2', 'N1', 'H1'],
                          ['C2', 'H21', 'N2', 'H22'], ['N7', 'N9', 'C8', 'H8'], ['N1', 'N3', 'C2', 'N2']],
           "C2": {'torsion': -0.1, 'tree': 'B', 'NC': 20, 'NB': 21, 'NA': 23, 'I': 25, 'angle': 125.24, 'blen': 1.38,
                  'charge': 0.7657, 'type': 'CA'},
           "N3": {'torsion': 0.0, 'tree': 'S', 'NC': 21, 'NB': 23, 'NA': 25, 'I': 29, 'angle': 123.3, 'blen': 1.33,
                  'charge': -0.6323, 'type': 'NC'},
           "P": {'torsion': 200.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 119.04, 'blen': 1.6,
                 'charge': 1.1662, 'type': 'P'},
           "H1": {'torsion': 179.9, 'tree': 'E', 'NC': 20, 'NB': 21, 'NA': 23, 'I': 24, 'angle': 117.36, 'blen': 1.0,
                  'charge': 0.3424, 'type': 'H'},
           "C8": {'torsion': 81.59, 'tree': 'B', 'NC': 13, 'NB': 14, 'NA': 16, 'I': 17, 'angle': 129.2, 'blen': 1.38,
                  'charge': 0.1374, 'type': 'CK'},
           "O4'": {'torsion': -86.31, 'tree': 'S', 'NC': 7, 'NB': 8, 'NA': 11, 'I': 13, 'angle': 108.86, 'blen': 1.46,
                   'charge': -0.3548, 'type': 'OS'},
           "INTX,KFORM": ['INT', '1'],
           "O5'": {'torsion': -98.89, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 7, 'angle': 101.43, 'blen': 1.6,
                   'charge': -0.4989, 'type': 'OS'},
           "N7": {'torsion': -179.9, 'tree': 'S', 'NC': 14, 'NB': 16, 'NA': 17, 'I': 19, 'angle': 114.0, 'blen': 1.31,
                  'charge': -0.5709, 'type': 'NB'},
           "IFIXC,IOMIT,ISYMDU,IPOS": ['CORRECT', 'OMIT', 'DU', 'BEG'],
           "N1": {'torsion': 180.0, 'tree': 'B', 'NC': 19, 'NB': 20, 'NA': 21, 'I': 23, 'angle': 111.38, 'blen': 1.4,
                  'charge': -0.4787, 'type': 'NA'},
           "loopList": [["C1'", "C2'"], ['C4', 'C5'], ['C4', 'N9']],
           "H21": {'torsion': -0.82, 'tree': 'E', 'NC': 23, 'NB': 25, 'NA': 26, 'I': 27, 'angle': 127.0, 'blen': 1.01,
                   'charge': 0.4364, 'type': 'H'},
           "NAMRES": "R-GUANOSINE - with 5' - phosphate group and 3' - O(minus) group",
           "HO'2": {'torsion': 180.0, 'tree': 'E', 'NC': 31, 'NB': 33, 'NA': 35, 'I': 36, 'angle': 107.0, 'blen': 0.96,
                    'charge': 0.4186, 'type': 'HO'},
           "H8": {'torsion': 0.0, 'tree': 'E', 'NC': 14, 'NB': 16, 'NA': 17, 'I': 18, 'angle': 120.0, 'blen': 1.08,
                  'charge': 0.164, 'type': 'H5'},
           "H4'": {'torsion': -200.0, 'tree': 'E', 'NC': 7, 'NB': 8, 'NA': 11, 'I': 12, 'angle': 109.5, 'blen': 1.09,
                   'charge': 0.1174, 'type': 'H1'},
           "H1'": {'torsion': -240.0, 'tree': 'E', 'NC': 11, 'NB': 13, 'NA': 14, 'I': 15, 'angle': 109.5, 'blen': 1.09,
                   'charge': 0.2006, 'type': 'H2'},
           "atNameList": ['P', 'O1P', 'O2P', "O5'", "C5'", "H5'1", "H5'2", "C4'", "H4'", "O4'", "C1'", "H1'", 'N9',
                          'C8', 'H8', 'N7', 'C5', 'C6', 'O6', 'N1', 'H1', 'C2', 'N2', 'H21', 'H22', 'N3', 'C4', "C3'",
                          "H3'", "C2'", "H2'1", "O2'", "HO'2", "O3'"],
           "DUMM": [['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.00', '0.00', '0.00', '0.0000'],
                    ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.00', '0.00', '0.00', '0.0000'],
                    ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.00', '90.00', '0.00', '0.0000']],
           "N2": {'torsion': 180.0, 'tree': 'B', 'NC': 21, 'NB': 23, 'NA': 25, 'I': 26, 'angle': 116.02, 'blen': 1.34,
                  'charge': -0.9672, 'type': 'N2'},
           "O6": {'torsion': 0.0, 'tree': 'E', 'NC': 19, 'NB': 20, 'NA': 21, 'I': 22, 'angle': 128.8, 'blen': 1.23,
                  'charge': -0.5597, 'type': 'O'},
           "C2'": {'torsion': -86.3, 'tree': 'B', 'NC': 8, 'NB': 11, 'NA': 31, 'I': 33, 'angle': 102.8, 'blen': 1.53,
                   'charge': 0.067, 'type': 'CT'},
           "H5'2": {'torsion': -60.0, 'tree': 'E', 'NC': 4, 'NB': 7, 'NA': 8, 'I': 10, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.0679, 'type': 'H1'},
           "H5'1": {'torsion': 60.0, 'tree': 'E', 'NC': 4, 'NB': 7, 'NA': 8, 'I': 9, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.0679, 'type': 'H1'},
           "H3'": {'torsion': 30.0, 'tree': 'E', 'NC': 8, 'NB': 11, 'NA': 31, 'I': 32, 'angle': 109.5, 'blen': 1.09,
                   'charge': 0.0615, 'type': 'H1'},
           "C4'": {'torsion': 180.0, 'tree': 'M', 'NC': 4, 'NB': 7, 'NA': 8, 'I': 11, 'angle': 110.0, 'blen': 1.52,
                   'charge': 0.1065, 'type': 'CT'},
           "H2'1": {'torsion': 120.0, 'tree': 'E', 'NC': 11, 'NB': 31, 'NA': 33, 'I': 34, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.0972, 'type': 'H1'},
           "N9": {'torsion': -127.7, 'tree': 'S', 'NC': 11, 'NB': 13, 'NA': 14, 'I': 16, 'angle': 108.06, 'blen': 1.49,
                  'charge': 0.0492, 'type': 'N*'},
           "C5'": {'torsion': -39.22, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 7, 'I': 8, 'angle': 119.0, 'blen': 1.44,
                   'charge': 0.0558, 'type': 'CT'},
           "H22": {'torsion': -179.44, 'tree': 'E', 'NC': 23, 'NB': 25, 'NA': 26, 'I': 28, 'angle': 116.53,
                   'blen': 1.01, 'charge': 0.4364, 'type': 'H'},
           "O2P": {'torsion': 20.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 6, 'angle': 109.58, 'blen': 1.48,
                   'charge': -0.776, 'type': 'O2'},
           "C1'": {'torsion': 105.6, 'tree': 'B', 'NC': 8, 'NB': 11, 'NA': 13, 'I': 14, 'angle': 110.04, 'blen': 1.42,
                   'charge': 0.0191, 'type': 'CT'},
           "C3'": {'torsion': -329.11, 'tree': 'M', 'NC': 7, 'NB': 8, 'NA': 11, 'I': 31, 'angle': 115.78, 'blen': 1.53,
                   'charge': 0.2022, 'type': 'CT'},
           "O1P": {'torsion': 150.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 109.61, 'blen': 1.48,
                   'charge': -0.776, 'type': 'O2'},
           "CUT": ['0.0'],
           },
    "IDBGEN,IREST,ITYPF": ['1', '0', '2'],
    "RC3": {"C4": {'torsion': 0.0, 'tree': 'B', 'NC': 16, 'NB': 17, 'NA': 19, 'I': 21, 'angle': 116.9, 'blen': 1.43,
                   'charge': 0.8185, 'type': 'CA'},
            "C5": {'torsion': 180.0, 'tree': 'B', 'NC': 14, 'NB': 16, 'NA': 17, 'I': 19, 'angle': 121.0, 'blen': 1.36,
                   'charge': -0.5215, 'type': 'CM'},
            "C6": {'torsion': 81.59, 'tree': 'B', 'NC': 13, 'NB': 14, 'NA': 16, 'I': 17, 'angle': 121.1, 'blen': 1.36,
                   'charge': 0.0053, 'type': 'CM'},
            "O3'": {'torsion': -203.47, 'tree': 'M', 'NC': 8, 'NB': 11, 'NA': 28, 'I': 34, 'angle': 116.52,
                    'blen': 1.42, 'charge': -0.6541, 'type': 'OH'},
            "H6": {'torsion': 0.0, 'tree': 'E', 'NC': 14, 'NB': 16, 'NA': 17, 'I': 18, 'angle': 120.0, 'blen': 1.08,
                   'charge': 0.1958, 'type': 'H4'},
            "O2'": {'torsion': 240.0, 'tree': 'S', 'NC': 11, 'NB': 28, 'NA': 30, 'I': 32, 'angle': 109.5, 'blen': 1.43,
                    'charge': -0.6139, 'type': 'OH'},
            "C2": {'torsion': 0.0, 'tree': 'S', 'NC': 19, 'NB': 21, 'NA': 25, 'I': 26, 'angle': 120.5, 'blen': 1.36,
                   'charge': 0.7538, 'type': 'C'},
            "H41": {'torsion': 180.0, 'tree': 'E', 'NC': 19, 'NB': 21, 'NA': 22, 'I': 23, 'angle': 117.7, 'blen': 1.01,
                    'charge': 0.4234, 'type': 'H'},
            "H42": {'torsion': 0.0, 'tree': 'E', 'NC': 19, 'NB': 21, 'NA': 22, 'I': 24, 'angle': 120.27, 'blen': 1.01,
                    'charge': 0.4234, 'type': 'H'},
            "O4'": {'torsion': -86.31, 'tree': 'S', 'NC': 7, 'NB': 8, 'NA': 11, 'I': 13, 'angle': 108.86, 'blen': 1.46,
                    'charge': -0.3548, 'type': 'OS'},
            "INTX,KFORM": ['INT', '1'],
            "O5'": {'torsion': -98.89, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 7, 'angle': 101.43, 'blen': 1.6,
                    'charge': -0.4989, 'type': 'OS'},
            "N3": {'torsion': 0.0, 'tree': 'S', 'NC': 17, 'NB': 19, 'NA': 21, 'I': 25, 'angle': 121.7, 'blen': 1.33,
                   'charge': -0.7584, 'type': 'NC'},
            "H3T": {'torsion': 180.0, 'tree': 'M', 'NC': 11, 'NB': 28, 'NA': 34, 'I': 35, 'angle': 114.97, 'blen': 0.96,
                    'charge': 0.4376, 'type': 'HO'},
            "IFIXC,IOMIT,ISYMDU,IPOS": ['CORRECT', 'OMIT', 'DU', 'BEG'],
            "loopList": [["C1'", "C2'"], ['C2', 'N1']],
            "N4": {'torsion': 180.0, 'tree': 'B', 'NC': 17, 'NB': 19, 'NA': 21, 'I': 22, 'angle': 120.1, 'blen': 1.32,
                   'charge': -0.953, 'type': 'N2'},
            "NAMRES": "R-CYTOSINE - with 5' - phosphate group and 3' - OH group",
            "HO'2": {'torsion': 180.0, 'tree': 'E', 'NC': 28, 'NB': 30, 'NA': 32, 'I': 33, 'angle': 107.0, 'blen': 0.96,
                     'charge': 0.4186, 'type': 'HO'},
            "H4'": {'torsion': -200.0, 'tree': 'E', 'NC': 7, 'NB': 8, 'NA': 11, 'I': 12, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.1174, 'type': 'H1'},
            "H1'": {'torsion': -240.0, 'tree': 'E', 'NC': 11, 'NB': 13, 'NA': 14, 'I': 15, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.2029, 'type': 'H2'},
            "O2": {'torsion': 180.0, 'tree': 'E', 'NC': 21, 'NB': 25, 'NA': 26, 'I': 27, 'angle': 122.4, 'blen': 1.24,
                   'charge': -0.6252, 'type': 'O'},
            "atNameList": ['P', 'O1P', 'O2P', "O5'", "C5'", "H5'1", "H5'2", "C4'", "H4'", "O4'", "C1'", "H1'", 'N1',
                           'C6', 'H6', 'C5', 'H5', 'C4', 'N4', 'H41', 'H42', 'N3', 'C2', 'O2', "C3'", "H3'", "C2'",
                           "H2'1", "O2'", "HO'2", "O3'", 'H3T'],
            "DUMM": [['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.00', '0.00', '0.00', '0.0000'],
                     ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.00', '0.00', '0.00', '0.0000'],
                     ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.00', '90.00', '0.00', '0.0000']],
            "H2'1": {'torsion': 120.0, 'tree': 'E', 'NC': 11, 'NB': 28, 'NA': 30, 'I': 31, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0972, 'type': 'H1'},
            "N1": {'torsion': -127.7, 'tree': 'S', 'NC': 11, 'NB': 13, 'NA': 14, 'I': 16, 'angle': 108.1, 'blen': 1.49,
                   'charge': -0.0484, 'type': 'N*'},
            "C2'": {'torsion': -86.3, 'tree': 'B', 'NC': 8, 'NB': 11, 'NA': 28, 'I': 30, 'angle': 102.8, 'blen': 1.53,
                    'charge': 0.067, 'type': 'CT'},
            "H5'2": {'torsion': -60.0, 'tree': 'E', 'NC': 4, 'NB': 7, 'NA': 8, 'I': 10, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0679, 'type': 'H1'},
            "H5'1": {'torsion': 60.0, 'tree': 'E', 'NC': 4, 'NB': 7, 'NA': 8, 'I': 9, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0679, 'type': 'H1'},
            "H3'": {'torsion': 30.0, 'tree': 'E', 'NC': 8, 'NB': 11, 'NA': 28, 'I': 29, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.0615, 'type': 'H1'},
            "C4'": {'torsion': 180.0, 'tree': 'M', 'NC': 4, 'NB': 7, 'NA': 8, 'I': 11, 'angle': 110.0, 'blen': 1.52,
                    'charge': 0.1065, 'type': 'CT'},
            "P": {'torsion': 200.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 119.04, 'blen': 1.6,
                  'charge': 1.1662, 'type': 'P'},
            "C5'": {'torsion': -39.22, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 7, 'I': 8, 'angle': 119.0, 'blen': 1.44,
                    'charge': 0.0558, 'type': 'CT'},
            "O2P": {'torsion': 20.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 6, 'angle': 109.58, 'blen': 1.48,
                    'charge': -0.776, 'type': 'O2'},
            "C1'": {'torsion': 105.6, 'tree': 'B', 'NC': 8, 'NB': 11, 'NA': 13, 'I': 14, 'angle': 110.04, 'blen': 1.42,
                    'charge': 0.0066, 'type': 'CT'},
            "C3'": {'torsion': -329.11, 'tree': 'M', 'NC': 7, 'NB': 8, 'NA': 11, 'I': 28, 'angle': 115.78, 'blen': 1.53,
                    'charge': 0.2022, 'type': 'CT'},
            "H5": {'torsion': 180.0, 'tree': 'E', 'NC': 16, 'NB': 17, 'NA': 19, 'I': 20, 'angle': 120.0, 'blen': 1.09,
                   'charge': 0.1928, 'type': 'HA'},
            "O1P": {'torsion': 150.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 109.61, 'blen': 1.48,
                    'charge': -0.776, 'type': 'O2'},
            "CUT": ['0.0'],
            "impropTors": [['C6', 'C2', 'N1', "C1'"], ['N1', 'N3', 'C2', 'O2'], ['C4', 'H41', 'N4', 'H42'],
                           ['N1', 'C5', 'C6', 'H6'], ['C6', 'C4', 'C5', 'H5'], ['N3', 'C5', 'C4', 'N4']],
            },
    "DGN": {"C4": {'torsion': 0.0, 'tree': 'E', 'NC': 21, 'NB': 23, 'NA': 27, 'I': 28, 'angle': 112.2, 'blen': 1.36,
                   'charge': 0.1814, 'type': 'CB'},
            "C5": {'torsion': 0.0, 'tree': 'S', 'NC': 14, 'NB': 15, 'NA': 17, 'I': 18, 'angle': 103.9, 'blen': 1.39,
                   'charge': 0.1991, 'type': 'CB'},
            "C6": {'torsion': 180.0, 'tree': 'B', 'NC': 15, 'NB': 17, 'NA': 18, 'I': 19, 'angle': 130.4, 'blen': 1.42,
                   'charge': 0.4918, 'type': 'C'},
            "O3'": {'torsion': -203.47, 'tree': 'M', 'NC': 6, 'NB': 9, 'NA': 29, 'I': 34, 'angle': 116.52, 'blen': 1.42,
                    'charge': -0.6549, 'type': 'OH'},
            "impropTors": [['C8', 'C4', 'N9', "C1'"], ['C5', 'N1', 'C6', 'O6'], ['C6', 'C2', 'N1', 'H1'],
                           ['C2', 'H21', 'N2', 'H22'], ['N7', 'N9', 'C8', 'H8'], ['N1', 'N3', 'C2', 'N2']],
            "C2": {'torsion': -0.1, 'tree': 'B', 'NC': 18, 'NB': 19, 'NA': 21, 'I': 23, 'angle': 125.24, 'blen': 1.38,
                   'charge': 0.7432, 'type': 'CA'},
            "N3": {'torsion': 0.0, 'tree': 'S', 'NC': 19, 'NB': 21, 'NA': 23, 'I': 27, 'angle': 123.3, 'blen': 1.33,
                   'charge': -0.6636, 'type': 'NC'},
            "C2'": {'torsion': -86.3, 'tree': 'B', 'NC': 6, 'NB': 9, 'NA': 29, 'I': 31, 'angle': 102.8, 'blen': 1.53,
                    'charge': -0.0854, 'type': 'CT'},
            "H1": {'torsion': 179.9, 'tree': 'E', 'NC': 18, 'NB': 19, 'NA': 21, 'I': 22, 'angle': 117.36, 'blen': 1.0,
                   'charge': 0.352, 'type': 'H'},
            "C8": {'torsion': 81.59, 'tree': 'B', 'NC': 11, 'NB': 12, 'NA': 14, 'I': 15, 'angle': 129.2, 'blen': 1.38,
                   'charge': 0.0736, 'type': 'CK'},
            "O4'": {'torsion': -86.31, 'tree': 'S', 'NC': 5, 'NB': 6, 'NA': 9, 'I': 11, 'angle': 108.86, 'blen': 1.46,
                    'charge': -0.3691, 'type': 'OS'},
            "INTX,KFORM": ['INT', '1'],
            "O5'": {'torsion': -98.89, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 101.43, 'blen': 0.96,
                    'charge': -0.6318, 'type': 'OH'},
            "N7": {'torsion': -179.9, 'tree': 'S', 'NC': 12, 'NB': 14, 'NA': 15, 'I': 17, 'angle': 114.0, 'blen': 1.31,
                   'charge': -0.5725, 'type': 'NB'},
            "H3T": {'torsion': 180.0, 'tree': 'M', 'NC': 9, 'NB': 29, 'NA': 34, 'I': 35, 'angle': 114.97, 'blen': 0.96,
                    'charge': 0.4396, 'type': 'HO'},
            "H2'2": {'torsion': 240.0, 'tree': 'E', 'NC': 9, 'NB': 29, 'NA': 31, 'I': 33, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0718, 'type': 'HC'},
            "IFIXC,IOMIT,ISYMDU,IPOS": ['CORRECT', 'NOMIT', 'DU', 'BEG'],
            "N1": {'torsion': 180.0, 'tree': 'B', 'NC': 17, 'NB': 18, 'NA': 19, 'I': 21, 'angle': 111.38, 'blen': 1.4,
                   'charge': -0.5053, 'type': 'NA'},
            "loopList": [["C1'", "C2'"], ['C4', 'C5'], ['C4', 'N9']],
            "H21": {'torsion': -0.82, 'tree': 'E', 'NC': 21, 'NB': 23, 'NA': 24, 'I': 25, 'angle': 127.0, 'blen': 1.01,
                    'charge': 0.4235, 'type': 'H'},
            "NAMRES": "D-GUANOSINE - with 5' - OH group and 3' - OH group",
            "H8": {'torsion': 0.0, 'tree': 'E', 'NC': 12, 'NB': 14, 'NA': 15, 'I': 16, 'angle': 120.0, 'blen': 1.08,
                   'charge': 0.1997, 'type': 'H5'},
            "H4'": {'torsion': -200.0, 'tree': 'E', 'NC': 5, 'NB': 6, 'NA': 9, 'I': 10, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.1176, 'type': 'H1'},
            "H1'": {'torsion': -240.0, 'tree': 'E', 'NC': 9, 'NB': 11, 'NA': 12, 'I': 13, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.1746, 'type': 'H2'},
            "atNameList": ['H5T', "O5'", "C5'", "H5'1", "H5'2", "C4'", "H4'", "O4'", "C1'", "H1'", 'N9', 'C8', 'H8',
                           'N7', 'C5', 'C6', 'O6', 'N1', 'H1', 'C2', 'N2', 'H21', 'H22', 'N3', 'C4', "C3'", "H3'",
                           "C2'", "H2'1", "H2'2", "O3'", 'H3T'],
            "DUMM": [['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.00', '0.00', '0.00', '0.0000'],
                     ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.00', '0.00', '0.00', '0.0000'],
                     ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.00', '90.00', '0.00', '0.0000']],
            "N2": {'torsion': 180.0, 'tree': 'B', 'NC': 19, 'NB': 21, 'NA': 23, 'I': 24, 'angle': 116.02, 'blen': 1.34,
                   'charge': -0.923, 'type': 'N2'},
            "O6": {'torsion': 0.0, 'tree': 'E', 'NC': 17, 'NB': 18, 'NA': 19, 'I': 20, 'angle': 128.8, 'blen': 1.23,
                   'charge': -0.5699, 'type': 'O'},
            "H5'2": {'torsion': -60.0, 'tree': 'E', 'NC': 4, 'NB': 5, 'NA': 6, 'I': 8, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0754, 'type': 'H1'},
            "H5'1": {'torsion': 60.0, 'tree': 'E', 'NC': 4, 'NB': 5, 'NA': 6, 'I': 7, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0754, 'type': 'H1'},
            "H3'": {'torsion': 30.0, 'tree': 'E', 'NC': 6, 'NB': 9, 'NA': 29, 'I': 30, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.0985, 'type': 'H1'},
            "C4'": {'torsion': -180.0, 'tree': 'M', 'NC': 4, 'NB': 5, 'NA': 6, 'I': 9, 'angle': 110.0, 'blen': 1.52,
                    'charge': 0.1629, 'type': 'CT'},
            "H2'1": {'torsion': 120.0, 'tree': 'E', 'NC': 9, 'NB': 29, 'NA': 31, 'I': 32, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0718, 'type': 'HC'},
            "N9": {'torsion': -127.7, 'tree': 'S', 'NC': 9, 'NB': 11, 'NA': 12, 'I': 14, 'angle': 108.06, 'blen': 1.49,
                   'charge': 0.0577, 'type': 'N*'},
            "H5T": {'torsion': 180.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 120.0, 'blen': 1.0,
                    'charge': 0.4422, 'type': 'HO'},
            "H22": {'torsion': -179.44, 'tree': 'E', 'NC': 21, 'NB': 23, 'NA': 24, 'I': 26, 'angle': 116.53,
                    'blen': 1.01, 'charge': 0.4235, 'type': 'H'},
            "C5'": {'torsion': -39.22, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 5, 'I': 6, 'angle': 119.0, 'blen': 1.44,
                    'charge': -0.0069, 'type': 'CT'},
            "C1'": {'torsion': 105.6, 'tree': 'B', 'NC': 5, 'NB': 9, 'NA': 11, 'I': 12, 'angle': 110.04, 'blen': 1.42,
                    'charge': 0.0358, 'type': 'CT'},
            "C3'": {'torsion': -329.11, 'tree': 'M', 'NC': 5, 'NB': 6, 'NA': 9, 'I': 29, 'angle': 115.78, 'blen': 1.53,
                    'charge': 0.0713, 'type': 'CT'},
            "CUT": ['0.0'],
            },
    "DA3": {"H2": {'torsion': 180.0, 'tree': 'E', 'NC': 21, 'NB': 25, 'NA': 26, 'I': 27, 'angle': 120.0, 'blen': 1.08,
                   'charge': 0.0598, 'type': 'H5'},
            "C5": {'torsion': 0.0, 'tree': 'S', 'NC': 16, 'NB': 17, 'NA': 19, 'I': 20, 'angle': 104.0, 'blen': 1.39,
                   'charge': 0.0725, 'type': 'CB'},
            "C6": {'torsion': 180.0, 'tree': 'B', 'NC': 17, 'NB': 19, 'NA': 20, 'I': 21, 'angle': 132.42, 'blen': 1.4,
                   'charge': 0.6897, 'type': 'CA'},
            "O3'": {'torsion': -203.47, 'tree': 'M', 'NC': 8, 'NB': 11, 'NA': 30, 'I': 35, 'angle': 116.52,
                    'blen': 1.42, 'charge': -0.6549, 'type': 'OH'},
            "H62": {'torsion': 0.0, 'tree': 'E', 'NC': 20, 'NB': 21, 'NA': 22, 'I': 24, 'angle': 120.0, 'blen': 1.01,
                    'charge': 0.4167, 'type': 'H'},
            "impropTors": [['C8', 'C4', 'N9', "C1'"], ['C6', 'H61', 'N6', 'H62'], ['N7', 'N9', 'C8', 'H8'],
                           ['N1', 'N3', 'C2', 'H2'], ['C5', 'N1', 'C6', 'N6']],
            "C2": {'torsion': 0.0, 'tree': 'B', 'NC': 20, 'NB': 21, 'NA': 25, 'I': 26, 'angle': 118.8, 'blen': 1.33,
                   'charge': 0.5716, 'type': 'CQ'},
            "H61": {'torsion': 180.0, 'tree': 'E', 'NC': 20, 'NB': 21, 'NA': 22, 'I': 23, 'angle': 120.0, 'blen': 1.01,
                    'charge': 0.4167, 'type': 'H'},
            "P": {'torsion': 200.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 119.04, 'blen': 1.6,
                  'charge': 1.1659, 'type': 'P'},
            "H2'1": {'torsion': 120.0, 'tree': 'E', 'NC': 11, 'NB': 30, 'NA': 32, 'I': 33, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0718, 'type': 'HC'},
            "C8": {'torsion': 81.59, 'tree': 'B', 'NC': 13, 'NB': 14, 'NA': 16, 'I': 17, 'angle': 131.2, 'blen': 1.37,
                   'charge': 0.1607, 'type': 'CK'},
            "O4'": {'torsion': -86.31, 'tree': 'S', 'NC': 7, 'NB': 8, 'NA': 11, 'I': 13, 'angle': 108.86, 'blen': 1.46,
                    'charge': -0.3691, 'type': 'OS'},
            "INTX,KFORM": ['INT', '1'],
            "O5'": {'torsion': -98.89, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 7, 'angle': 101.43, 'blen': 1.6,
                    'charge': -0.4954, 'type': 'OS'},
            "N7": {'torsion': 177.0, 'tree': 'S', 'NC': 14, 'NB': 16, 'NA': 17, 'I': 19, 'angle': 113.93, 'blen': 1.3,
                   'charge': -0.6175, 'type': 'NB'},
            "H3T": {'torsion': 180.0, 'tree': 'M', 'NC': 11, 'NB': 30, 'NA': 35, 'I': 36, 'angle': 114.97, 'blen': 0.96,
                    'charge': 0.4396, 'type': 'HO'},
            "H2'2": {'torsion': 240.0, 'tree': 'E', 'NC': 11, 'NB': 30, 'NA': 32, 'I': 34, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0718, 'type': 'HC'},
            "IFIXC,IOMIT,ISYMDU,IPOS": ['CORRECT', 'OMIT', 'DU', 'BEG'],
            "C4": {'torsion': 0.0, 'tree': 'E', 'NC': 25, 'NB': 26, 'NA': 28, 'I': 29, 'angle': 110.8, 'blen': 1.35,
                   'charge': 0.38, 'type': 'CB'},
            "loopList": [["C1'", "C2'"], ['C4', 'C5'], ['C4', 'N9']],
            "H3'": {'torsion': 30.0, 'tree': 'E', 'NC': 8, 'NB': 11, 'NA': 30, 'I': 31, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.0985, 'type': 'H1'},
            "NAMRES": "D-ADENOSINE - with 5' - phosphate group and 3' - OH group",
            "H8": {'torsion': 0.0, 'tree': 'E', 'NC': 14, 'NB': 16, 'NA': 17, 'I': 18, 'angle': 120.0, 'blen': 1.08,
                   'charge': 0.1877, 'type': 'H5'},
            "H4'": {'torsion': -200.0, 'tree': 'E', 'NC': 7, 'NB': 8, 'NA': 11, 'I': 12, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.1176, 'type': 'H1'},
            "H1'": {'torsion': -240.0, 'tree': 'E', 'NC': 11, 'NB': 13, 'NA': 14, 'I': 15, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.1838, 'type': 'H2'},
            "N6": {'torsion': 0.0, 'tree': 'B', 'NC': 19, 'NB': 20, 'NA': 21, 'I': 22, 'angle': 123.5, 'blen': 1.34,
                   'charge': -0.9123, 'type': 'N2'},
            "atNameList": ['P', 'O1P', 'O2P', "O5'", "C5'", "H5'1", "H5'2", "C4'", "H4'", "O4'", "C1'", "H1'", 'N9',
                           'C8', 'H8', 'N7', 'C5', 'C6', 'N6', 'H61', 'H62', 'N1', 'C2', 'H2', 'N3', 'C4', "C3'", "H3'",
                           "C2'", "H2'1", "H2'2", "O3'", 'H3T'],
            "DUMM": [['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.00', '0.00', '0.00', '0.0000'],
                     ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.00', '0.00', '0.00', '0.0000'],
                     ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.00', '90.00', '0.00', '0.0000']],
            "N1": {'torsion': 180.0, 'tree': 'S', 'NC': 19, 'NB': 20, 'NA': 21, 'I': 25, 'angle': 117.43, 'blen': 1.34,
                   'charge': -0.7624, 'type': 'NC'},
            "C2'": {'torsion': -86.3, 'tree': 'B', 'NC': 8, 'NB': 11, 'NA': 30, 'I': 32, 'angle': 102.8, 'blen': 1.53,
                    'charge': -0.0854, 'type': 'CT'},
            "H5'2": {'torsion': -60.0, 'tree': 'E', 'NC': 4, 'NB': 7, 'NA': 8, 'I': 10, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0754, 'type': 'H1'},
            "H5'1": {'torsion': 60.0, 'tree': 'E', 'NC': 4, 'NB': 7, 'NA': 8, 'I': 9, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0754, 'type': 'H1'},
            "C4'": {'torsion': 180.0, 'tree': 'M', 'NC': 4, 'NB': 7, 'NA': 8, 'I': 11, 'angle': 110.0, 'blen': 1.52,
                    'charge': 0.1629, 'type': 'CT'},
            "N9": {'torsion': -127.7, 'tree': 'S', 'NC': 11, 'NB': 13, 'NA': 14, 'I': 16, 'angle': 109.59, 'blen': 1.52,
                   'charge': -0.0268, 'type': 'N*'},
            "C5'": {'torsion': -39.22, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 7, 'I': 8, 'angle': 119.0, 'blen': 1.44,
                    'charge': -0.0069, 'type': 'CT'},
            "O2P": {'torsion': 20.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 6, 'angle': 109.58, 'blen': 1.48,
                    'charge': -0.7761, 'type': 'O2'},
            "C1'": {'torsion': 105.6, 'tree': 'B', 'NC': 8, 'NB': 11, 'NA': 13, 'I': 14, 'angle': 110.04, 'blen': 1.42,
                    'charge': 0.0431, 'type': 'CT'},
            "C3'": {'torsion': -329.11, 'tree': 'M', 'NC': 7, 'NB': 8, 'NA': 11, 'I': 30, 'angle': 115.78, 'blen': 1.53,
                    'charge': 0.0713, 'type': 'CT'},
            "N3": {'torsion': 0.0, 'tree': 'S', 'NC': 21, 'NB': 25, 'NA': 26, 'I': 28, 'angle': 129.17, 'blen': 1.32,
                   'charge': -0.7417, 'type': 'NC'},
            "O1P": {'torsion': 150.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 109.61, 'blen': 1.48,
                    'charge': -0.7761, 'type': 'O2'},
            "CUT": ['0.0'],
            },
    "RC5": {"C4": {'torsion': 0.0, 'tree': 'B', 'NC': 14, 'NB': 15, 'NA': 17, 'I': 19, 'angle': 116.9, 'blen': 1.43,
                   'charge': 0.8185, 'type': 'CA'},
            "C5": {'torsion': 180.0, 'tree': 'B', 'NC': 12, 'NB': 14, 'NA': 15, 'I': 17, 'angle': 121.0, 'blen': 1.36,
                   'charge': -0.5215, 'type': 'CM'},
            "C6": {'torsion': 81.59, 'tree': 'B', 'NC': 11, 'NB': 12, 'NA': 14, 'I': 15, 'angle': 121.1, 'blen': 1.36,
                   'charge': 0.0053, 'type': 'CM'},
            "O3'": {'torsion': -203.47, 'tree': 'M', 'NC': 6, 'NB': 9, 'NA': 26, 'I': 32, 'angle': 116.52, 'blen': 1.42,
                    'charge': -0.5246, 'type': 'OS'},
            "H6": {'torsion': 0.0, 'tree': 'E', 'NC': 12, 'NB': 14, 'NA': 15, 'I': 16, 'angle': 120.0, 'blen': 1.08,
                   'charge': 0.1958, 'type': 'H4'},
            "O2'": {'torsion': 240.0, 'tree': 'S', 'NC': 9, 'NB': 26, 'NA': 28, 'I': 30, 'angle': 109.5, 'blen': 1.43,
                    'charge': -0.6139, 'type': 'OH'},
            "C2": {'torsion': 0.0, 'tree': 'S', 'NC': 17, 'NB': 19, 'NA': 23, 'I': 24, 'angle': 120.5, 'blen': 1.36,
                   'charge': 0.7538, 'type': 'C'},
            "H41": {'torsion': 180.0, 'tree': 'E', 'NC': 17, 'NB': 19, 'NA': 20, 'I': 21, 'angle': 117.7, 'blen': 1.01,
                    'charge': 0.4234, 'type': 'H'},
            "H42": {'torsion': 0.0, 'tree': 'E', 'NC': 17, 'NB': 19, 'NA': 20, 'I': 22, 'angle': 120.27, 'blen': 1.01,
                    'charge': 0.4234, 'type': 'H'},
            "O4'": {'torsion': -86.31, 'tree': 'S', 'NC': 5, 'NB': 6, 'NA': 9, 'I': 11, 'angle': 108.86, 'blen': 1.46,
                    'charge': -0.3548, 'type': 'OS'},
            "INTX,KFORM": ['INT', '1'],
            "O5'": {'torsion': -98.89, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 101.43, 'blen': 0.96,
                    'charge': -0.6223, 'type': 'OH'},
            "N3": {'torsion': 0.0, 'tree': 'S', 'NC': 15, 'NB': 17, 'NA': 19, 'I': 23, 'angle': 121.7, 'blen': 1.33,
                   'charge': -0.7584, 'type': 'NC'},
            "IFIXC,IOMIT,ISYMDU,IPOS": ['CORRECT', 'NOMIT', 'DU', 'BEG'],
            "loopList": [["C1'", "C2'"], ['C2', 'N1']],
            "N4": {'torsion': 180.0, 'tree': 'B', 'NC': 15, 'NB': 17, 'NA': 19, 'I': 20, 'angle': 120.1, 'blen': 1.32,
                   'charge': -0.953, 'type': 'N2'},
            "NAMRES": "R-CYTOSINE - with 5' - OH end group and 3' - O(minus) group",
            "HO'2": {'torsion': 180.0, 'tree': 'E', 'NC': 26, 'NB': 28, 'NA': 30, 'I': 31, 'angle': 107.0, 'blen': 0.96,
                     'charge': 0.4186, 'type': 'HO'},
            "H4'": {'torsion': -200.0, 'tree': 'E', 'NC': 5, 'NB': 6, 'NA': 9, 'I': 10, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.1174, 'type': 'H1'},
            "H1'": {'torsion': -240.0, 'tree': 'E', 'NC': 9, 'NB': 11, 'NA': 12, 'I': 13, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.2029, 'type': 'H2'},
            "O2": {'torsion': 180.0, 'tree': 'E', 'NC': 19, 'NB': 23, 'NA': 24, 'I': 25, 'angle': 122.4, 'blen': 1.24,
                   'charge': -0.6252, 'type': 'O'},
            "atNameList": ['H5T', "O5'", "C5'", "H5'1", "H5'2", "C4'", "H4'", "O4'", "C1'", "H1'", 'N1', 'C6', 'H6',
                           'C5', 'H5', 'C4', 'N4', 'H41', 'H42', 'N3', 'C2', 'O2', "C3'", "H3'", "C2'", "H2'1", "O2'",
                           "HO'2", "O3'"],
            "DUMM": [['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.00', '0.00', '0.00', '0.0000'],
                     ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.00', '0.00', '0.00', '0.0000'],
                     ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.00', '90.00', '0.00', '0.0000']],
            "H2'1": {'torsion': 120.0, 'tree': 'E', 'NC': 9, 'NB': 26, 'NA': 28, 'I': 29, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0972, 'type': 'H1'},
            "N1": {'torsion': -127.7, 'tree': 'S', 'NC': 9, 'NB': 11, 'NA': 12, 'I': 14, 'angle': 108.1, 'blen': 1.49,
                   'charge': -0.0484, 'type': 'N*'},
            "C2'": {'torsion': -86.3, 'tree': 'B', 'NC': 6, 'NB': 9, 'NA': 26, 'I': 28, 'angle': 102.8, 'blen': 1.53,
                    'charge': 0.067, 'type': 'CT'},
            "H5'2": {'torsion': -60.0, 'tree': 'E', 'NC': 4, 'NB': 5, 'NA': 6, 'I': 8, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0679, 'type': 'H1'},
            "H5'1": {'torsion': 60.0, 'tree': 'E', 'NC': 4, 'NB': 5, 'NA': 6, 'I': 7, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0679, 'type': 'H1'},
            "H3'": {'torsion': 30.0, 'tree': 'E', 'NC': 6, 'NB': 9, 'NA': 26, 'I': 27, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.0615, 'type': 'H1'},
            "C4'": {'torsion': -180.0, 'tree': 'M', 'NC': 4, 'NB': 5, 'NA': 6, 'I': 9, 'angle': 110.0, 'blen': 1.52,
                    'charge': 0.1065, 'type': 'CT'},
            "H5T": {'torsion': 180.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 120.0, 'blen': 1.0,
                    'charge': 0.4295, 'type': 'HO'},
            "C5'": {'torsion': -39.22, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 5, 'I': 6, 'angle': 119.0, 'blen': 1.44,
                    'charge': 0.0558, 'type': 'CT'},
            "C1'": {'torsion': 105.6, 'tree': 'B', 'NC': 5, 'NB': 9, 'NA': 11, 'I': 12, 'angle': 110.04, 'blen': 1.42,
                    'charge': 0.0066, 'type': 'CT'},
            "C3'": {'torsion': -329.11, 'tree': 'M', 'NC': 5, 'NB': 6, 'NA': 9, 'I': 26, 'angle': 115.78, 'blen': 1.53,
                    'charge': 0.2022, 'type': 'CT'},
            "H5": {'torsion': 180.0, 'tree': 'E', 'NC': 14, 'NB': 15, 'NA': 17, 'I': 18, 'angle': 120.0, 'blen': 1.09,
                   'charge': 0.1928, 'type': 'HA'},
            "CUT": ['0.0'],
            "impropTors": [['C6', 'C2', 'N1', "C1'"], ['N1', 'N3', 'C2', 'O2'], ['C4', 'H41', 'N4', 'H42'],
                           ['N1', 'C5', 'C6', 'H6'], ['C6', 'C4', 'C5', 'H5'], ['N3', 'C5', 'C4', 'N4']],
            },
    "RAN": {"H2": {'torsion': 180.0, 'tree': 'E', 'NC': 19, 'NB': 23, 'NA': 24, 'I': 25, 'angle': 120.0, 'blen': 1.08,
                   'charge': 0.0473, 'type': 'H5'},
            "C5": {'torsion': 0.0, 'tree': 'S', 'NC': 14, 'NB': 15, 'NA': 17, 'I': 18, 'angle': 104.0, 'blen': 1.39,
                   'charge': 0.0515, 'type': 'CB'},
            "C6": {'torsion': 180.0, 'tree': 'B', 'NC': 15, 'NB': 17, 'NA': 18, 'I': 19, 'angle': 132.42, 'blen': 1.4,
                   'charge': 0.7009, 'type': 'CA'},
            "O3'": {'torsion': -203.47, 'tree': 'M', 'NC': 6, 'NB': 9, 'NA': 28, 'I': 34, 'angle': 116.52, 'blen': 1.42,
                    'charge': -0.6541, 'type': 'OH'},
            "H62": {'torsion': 0.0, 'tree': 'E', 'NC': 18, 'NB': 19, 'NA': 20, 'I': 22, 'angle': 120.0, 'blen': 1.01,
                    'charge': 0.4115, 'type': 'H'},
            "O2'": {'torsion': 240.0, 'tree': 'S', 'NC': 9, 'NB': 28, 'NA': 30, 'I': 32, 'angle': 109.5, 'blen': 1.43,
                    'charge': -0.6139, 'type': 'OH'},
            "C2": {'torsion': 0.0, 'tree': 'B', 'NC': 18, 'NB': 19, 'NA': 23, 'I': 24, 'angle': 118.8, 'blen': 1.33,
                   'charge': 0.5875, 'type': 'CQ'},
            "H61": {'torsion': 180.0, 'tree': 'E', 'NC': 18, 'NB': 19, 'NA': 20, 'I': 21, 'angle': 120.0, 'blen': 1.01,
                    'charge': 0.4115, 'type': 'H'},
            "C2'": {'torsion': -86.3, 'tree': 'B', 'NC': 6, 'NB': 9, 'NA': 28, 'I': 30, 'angle': 102.8, 'blen': 1.53,
                    'charge': 0.067, 'type': 'CT'},
            "H2'1": {'torsion': 120.0, 'tree': 'E', 'NC': 9, 'NB': 28, 'NA': 30, 'I': 31, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0972, 'type': 'H1'},
            "C8": {'torsion': 81.59, 'tree': 'B', 'NC': 11, 'NB': 12, 'NA': 14, 'I': 15, 'angle': 131.2, 'blen': 1.37,
                   'charge': 0.2006, 'type': 'CK'},
            "O4'": {'torsion': -86.31, 'tree': 'S', 'NC': 5, 'NB': 6, 'NA': 9, 'I': 11, 'angle': 108.86, 'blen': 1.46,
                    'charge': -0.3548, 'type': 'OS'},
            "INTX,KFORM": ['INT', '1'],
            "O5'": {'torsion': -98.89, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 101.43, 'blen': 0.96,
                    'charge': -0.6223, 'type': 'OH'},
            "N7": {'torsion': 177.0, 'tree': 'S', 'NC': 12, 'NB': 14, 'NA': 15, 'I': 17, 'angle': 113.93, 'blen': 1.3,
                   'charge': -0.6073, 'type': 'NB'},
            "H3T": {'torsion': 180.0, 'tree': 'M', 'NC': 9, 'NB': 28, 'NA': 34, 'I': 35, 'angle': 114.97, 'blen': 0.96,
                    'charge': 0.4376, 'type': 'HO'},
            "IFIXC,IOMIT,ISYMDU,IPOS": ['CORRECT', 'NOMIT', 'DU', 'BEG'],
            "C4": {'torsion': 0.0, 'tree': 'E', 'NC': 23, 'NB': 24, 'NA': 26, 'I': 27, 'angle': 110.8, 'blen': 1.35,
                   'charge': 0.3053, 'type': 'CB'},
            "loopList": [["C1'", "C2'"], ['C4', 'C5'], ['C4', 'N9']],
            "H3'": {'torsion': 30.0, 'tree': 'E', 'NC': 6, 'NB': 9, 'NA': 28, 'I': 29, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.0615, 'type': 'H1'},
            "NAMRES": "R-ADENOSINE - with 5' - OH group and 3' - OH group",
            "HO'2": {'torsion': 180.0, 'tree': 'E', 'NC': 28, 'NB': 30, 'NA': 32, 'I': 33, 'angle': 107.0, 'blen': 0.96,
                     'charge': 0.4186, 'type': 'HO'},
            "H8": {'torsion': 0.0, 'tree': 'E', 'NC': 12, 'NB': 14, 'NA': 15, 'I': 16, 'angle': 120.0, 'blen': 1.08,
                   'charge': 0.1553, 'type': 'H5'},
            "H4'": {'torsion': -200.0, 'tree': 'E', 'NC': 5, 'NB': 6, 'NA': 9, 'I': 10, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.1174, 'type': 'H1'},
            "H1'": {'torsion': -240.0, 'tree': 'E', 'NC': 9, 'NB': 11, 'NA': 12, 'I': 13, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.2007, 'type': 'H2'},
            "N6": {'torsion': 0.0, 'tree': 'B', 'NC': 17, 'NB': 18, 'NA': 19, 'I': 20, 'angle': 123.5, 'blen': 1.34,
                   'charge': -0.9019, 'type': 'N2'},
            "atNameList": ['H5T', "O5'", "C5'", "H5'1", "H5'2", "C4'", "H4'", "O4'", "C1'", "H1'", 'N9', 'C8', 'H8',
                           'N7', 'C5', 'C6', 'N6', 'H61', 'H62', 'N1', 'C2', 'H2', 'N3', 'C4', "C3'", "H3'", "C2'",
                           "H2'1", "O2'", "HO'2", "O3'", 'H3T'],
            "DUMM": [['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.00', '0.00', '0.00', '0.0000'],
                     ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.00', '0.00', '0.00', '0.0000'],
                     ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.00', '90.00', '0.00', '0.0000']],
            "N1": {'torsion': 180.0, 'tree': 'S', 'NC': 17, 'NB': 18, 'NA': 19, 'I': 23, 'angle': 117.43, 'blen': 1.34,
                   'charge': -0.7615, 'type': 'NC'},
            "H5'2": {'torsion': -60.0, 'tree': 'E', 'NC': 4, 'NB': 5, 'NA': 6, 'I': 8, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0679, 'type': 'H1'},
            "H5'1": {'torsion': 60.0, 'tree': 'E', 'NC': 4, 'NB': 5, 'NA': 6, 'I': 7, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0679, 'type': 'H1'},
            "C4'": {'torsion': 180.0, 'tree': 'M', 'NC': 4, 'NB': 5, 'NA': 6, 'I': 9, 'angle': 110.0, 'blen': 1.52,
                    'charge': 0.1065, 'type': 'CT'},
            "N9": {'torsion': -127.7, 'tree': 'S', 'NC': 9, 'NB': 11, 'NA': 12, 'I': 14, 'angle': 109.59, 'blen': 1.52,
                   'charge': -0.0251, 'type': 'N*'},
            "H5T": {'torsion': 180.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 120.0, 'blen': 1.0,
                    'charge': 0.4295, 'type': 'HO'},
            "C5'": {'torsion': -39.22, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 5, 'I': 6, 'angle': 119.0, 'blen': 1.44,
                    'charge': 0.0558, 'type': 'CT'},
            "C1'": {'torsion': 105.6, 'tree': 'B', 'NC': 6, 'NB': 9, 'NA': 11, 'I': 12, 'angle': 110.04, 'blen': 1.42,
                    'charge': 0.0394, 'type': 'CT'},
            "C3'": {'torsion': -329.11, 'tree': 'M', 'NC': 5, 'NB': 6, 'NA': 9, 'I': 28, 'angle': 115.78, 'blen': 1.53,
                    'charge': 0.2022, 'type': 'CT'},
            "N3": {'torsion': 0.0, 'tree': 'S', 'NC': 19, 'NB': 23, 'NA': 24, 'I': 26, 'angle': 129.17, 'blen': 1.32,
                   'charge': -0.6997, 'type': 'NC'},
            "CUT": ['0.0'],
            "impropTors": [['C8', 'C4', 'N9', "C1'"], ['C6', 'H61', 'N6', 'H62'], ['N7', 'N9', 'C8', 'H8'],
                           ['N1', 'N3', 'C2', 'H2'], ['C5', 'N1', 'C6', 'N6']],
            },
    "DA5": {"H2": {'torsion': 180.0, 'tree': 'E', 'NC': 19, 'NB': 23, 'NA': 24, 'I': 25, 'angle': 120.0, 'blen': 1.08,
                   'charge': 0.0598, 'type': 'H5'},
            "C5": {'torsion': 0.0, 'tree': 'S', 'NC': 14, 'NB': 15, 'NA': 17, 'I': 18, 'angle': 104.0, 'blen': 1.39,
                   'charge': 0.0725, 'type': 'CB'},
            "C6": {'torsion': 180.0, 'tree': 'B', 'NC': 15, 'NB': 17, 'NA': 18, 'I': 19, 'angle': 132.42, 'blen': 1.4,
                   'charge': 0.6897, 'type': 'CA'},
            "O3'": {'torsion': -203.47, 'tree': 'M', 'NC': 6, 'NB': 9, 'NA': 28, 'I': 33, 'angle': 116.52, 'blen': 1.42,
                    'charge': -0.5232, 'type': 'OS'},
            "H62": {'torsion': 0.0, 'tree': 'E', 'NC': 18, 'NB': 19, 'NA': 20, 'I': 22, 'angle': 120.0, 'blen': 1.01,
                    'charge': 0.4167, 'type': 'H'},
            "impropTors": [['C8', 'C4', 'N9', "C1'"], ['C6', 'H61', 'N6', 'H62'], ['N7', 'N9', 'C8', 'H8'],
                           ['N1', 'N3', 'C2', 'H2'], ['C5', 'N1', 'C6', 'N6']],
            "C2": {'torsion': 0.0, 'tree': 'B', 'NC': 18, 'NB': 19, 'NA': 23, 'I': 24, 'angle': 118.8, 'blen': 1.33,
                   'charge': 0.5716, 'type': 'CQ'},
            "H61": {'torsion': 180.0, 'tree': 'E', 'NC': 18, 'NB': 19, 'NA': 20, 'I': 21, 'angle': 120.0, 'blen': 1.01,
                    'charge': 0.4167, 'type': 'H'},
            "C2'": {'torsion': -86.3, 'tree': 'B', 'NC': 6, 'NB': 9, 'NA': 28, 'I': 30, 'angle': 102.8, 'blen': 1.53,
                    'charge': -0.0854, 'type': 'CT'},
            "H2'1": {'torsion': 120.0, 'tree': 'E', 'NC': 9, 'NB': 28, 'NA': 30, 'I': 31, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0718, 'type': 'HC'},
            "C8": {'torsion': 81.59, 'tree': 'B', 'NC': 11, 'NB': 12, 'NA': 14, 'I': 15, 'angle': 131.2, 'blen': 1.37,
                   'charge': 0.1607, 'type': 'CK'},
            "O4'": {'torsion': -86.31, 'tree': 'S', 'NC': 5, 'NB': 6, 'NA': 9, 'I': 11, 'angle': 108.86, 'blen': 1.46,
                    'charge': -0.3691, 'type': 'OS'},
            "INTX,KFORM": ['INT', '1'],
            "O5'": {'torsion': -98.89, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 101.43, 'blen': 0.96,
                    'charge': -0.6318, 'type': 'OH'},
            "N7": {'torsion': 177.0, 'tree': 'S', 'NC': 12, 'NB': 14, 'NA': 15, 'I': 17, 'angle': 113.93, 'blen': 1.3,
                   'charge': -0.6175, 'type': 'NB'},
            "H2'2": {'torsion': 240.0, 'tree': 'E', 'NC': 9, 'NB': 28, 'NA': 30, 'I': 32, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0718, 'type': 'HC'},
            "IFIXC,IOMIT,ISYMDU,IPOS": ['CORRECT', 'NOMIT', 'DU', 'BEG'],
            "C4": {'torsion': 0.0, 'tree': 'E', 'NC': 23, 'NB': 24, 'NA': 26, 'I': 27, 'angle': 110.8, 'blen': 1.35,
                   'charge': 0.38, 'type': 'CB'},
            "loopList": [["C1'", "C2'"], ['C4', 'C5'], ['C4', 'N9']],
            "H3'": {'torsion': 30.0, 'tree': 'E', 'NC': 6, 'NB': 9, 'NA': 28, 'I': 29, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.0985, 'type': 'H1'},
            "NAMRES": "D-ADENOSINE - with 5' - OH end group and 3' - O(minus)",
            "H8": {'torsion': 0.0, 'tree': 'E', 'NC': 12, 'NB': 14, 'NA': 15, 'I': 16, 'angle': 120.0, 'blen': 1.08,
                   'charge': 0.1877, 'type': 'H5'},
            "H4'": {'torsion': -200.0, 'tree': 'E', 'NC': 5, 'NB': 6, 'NA': 9, 'I': 10, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.1176, 'type': 'H1'},
            "H1'": {'torsion': -240.0, 'tree': 'E', 'NC': 9, 'NB': 11, 'NA': 12, 'I': 13, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.1838, 'type': 'H2'},
            "N6": {'torsion': 0.0, 'tree': 'B', 'NC': 17, 'NB': 18, 'NA': 19, 'I': 20, 'angle': 123.5, 'blen': 1.34,
                   'charge': -0.9123, 'type': 'N2'},
            "atNameList": ['H5T', "O5'", "C5'", "H5'1", "H5'2", "C4'", "H4'", "O4'", "C1'", "H1'", 'N9', 'C8', 'H8',
                           'N7', 'C5', 'C6', 'N6', 'H61', 'H62', 'N1', 'C2', 'H2', 'N3', 'C4', "C3'", "H3'", "C2'",
                           "H2'1", "H2'2", "O3'"],
            "DUMM": [['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.00', '0.00', '0.00', '0.0000'],
                     ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.00', '0.00', '0.00', '0.0000'],
                     ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.00', '90.00', '0.00', '0.0000']],
            "N1": {'torsion': 180.0, 'tree': 'S', 'NC': 17, 'NB': 18, 'NA': 19, 'I': 23, 'angle': 117.43, 'blen': 1.34,
                   'charge': -0.7624, 'type': 'NC'},
            "H5'2": {'torsion': -60.0, 'tree': 'E', 'NC': 4, 'NB': 5, 'NA': 6, 'I': 8, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0754, 'type': 'H1'},
            "H5'1": {'torsion': 60.0, 'tree': 'E', 'NC': 4, 'NB': 5, 'NA': 6, 'I': 7, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0754, 'type': 'H1'},
            "C4'": {'torsion': 180.0, 'tree': 'M', 'NC': 4, 'NB': 5, 'NA': 6, 'I': 9, 'angle': 110.0, 'blen': 1.52,
                    'charge': 0.1629, 'type': 'CT'},
            "N9": {'torsion': -127.7, 'tree': 'S', 'NC': 9, 'NB': 11, 'NA': 12, 'I': 14, 'angle': 109.59, 'blen': 1.52,
                   'charge': -0.0268, 'type': 'N*'},
            "H5T": {'torsion': 180.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 120.0, 'blen': 1.0,
                    'charge': 0.4422, 'type': 'HO'},
            "C5'": {'torsion': -39.22, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 5, 'I': 6, 'angle': 119.0, 'blen': 1.44,
                    'charge': -0.0069, 'type': 'CT'},
            "C1'": {'torsion': 105.6, 'tree': 'B', 'NC': 6, 'NB': 9, 'NA': 11, 'I': 12, 'angle': 110.04, 'blen': 1.42,
                    'charge': 0.0431, 'type': 'CT'},
            "C3'": {'torsion': -329.11, 'tree': 'M', 'NC': 5, 'NB': 6, 'NA': 9, 'I': 28, 'angle': 115.78, 'blen': 1.53,
                    'charge': 0.0713, 'type': 'CT'},
            "N3": {'torsion': 0.0, 'tree': 'S', 'NC': 19, 'NB': 23, 'NA': 24, 'I': 26, 'angle': 129.17, 'blen': 1.32,
                   'charge': -0.7417, 'type': 'NC'},
            "CUT": ['0.0'],
            },
    "RG5": {"C4": {'torsion': 0.0, 'tree': 'E', 'NC': 21, 'NB': 23, 'NA': 27, 'I': 28, 'angle': 112.2, 'blen': 1.36,
                   'charge': 0.1222, 'type': 'CB'},
            "C5": {'torsion': 0.0, 'tree': 'S', 'NC': 14, 'NB': 15, 'NA': 17, 'I': 18, 'angle': 103.9, 'blen': 1.39,
                   'charge': 0.1744, 'type': 'CB'},
            "C6": {'torsion': 180.0, 'tree': 'B', 'NC': 15, 'NB': 17, 'NA': 18, 'I': 19, 'angle': 130.4, 'blen': 1.42,
                   'charge': 0.477, 'type': 'C'},
            "O3'": {'torsion': -203.47, 'tree': 'M', 'NC': 6, 'NB': 9, 'NA': 29, 'I': 35, 'angle': 116.52, 'blen': 1.42,
                    'charge': -0.5246, 'type': 'OS'},
            "O2'": {'torsion': 240.0, 'tree': 'S', 'NC': 9, 'NB': 29, 'NA': 31, 'I': 33, 'angle': 109.5, 'blen': 1.43,
                    'charge': -0.6139, 'type': 'OH'},
            "impropTors": [['C8', 'C4', 'N9', "C1'"], ['C5', 'N1', 'C6', 'O6'], ['C6', 'C2', 'N1', 'H1'],
                           ['C2', 'H21', 'N2', 'H22'], ['N7', 'N9', 'C8', 'H8'], ['N1', 'N3', 'C2', 'N2']],
            "C2": {'torsion': -0.1, 'tree': 'B', 'NC': 18, 'NB': 19, 'NA': 21, 'I': 23, 'angle': 125.24, 'blen': 1.38,
                   'charge': 0.7657, 'type': 'CA'},
            "N3": {'torsion': 0.0, 'tree': 'S', 'NC': 19, 'NB': 21, 'NA': 23, 'I': 27, 'angle': 123.3, 'blen': 1.33,
                   'charge': -0.6323, 'type': 'NC'},
            "C2'": {'torsion': -86.3, 'tree': 'B', 'NC': 6, 'NB': 9, 'NA': 29, 'I': 31, 'angle': 102.8, 'blen': 1.53,
                    'charge': 0.067, 'type': 'CT'},
            "H1": {'torsion': 179.9, 'tree': 'E', 'NC': 18, 'NB': 19, 'NA': 21, 'I': 22, 'angle': 117.36, 'blen': 1.0,
                   'charge': 0.3424, 'type': 'H'},
            "C8": {'torsion': 81.59, 'tree': 'B', 'NC': 11, 'NB': 12, 'NA': 14, 'I': 15, 'angle': 129.2, 'blen': 1.38,
                   'charge': 0.1374, 'type': 'CK'},
            "O4'": {'torsion': -86.31, 'tree': 'S', 'NC': 5, 'NB': 6, 'NA': 9, 'I': 11, 'angle': 108.86, 'blen': 1.46,
                    'charge': -0.3548, 'type': 'OS'},
            "INTX,KFORM": ['INT', '1'],
            "O5'": {'torsion': -98.89, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 101.43, 'blen': 0.96,
                    'charge': -0.6223, 'type': 'OH'},
            "N7": {'torsion': -179.9, 'tree': 'S', 'NC': 12, 'NB': 14, 'NA': 15, 'I': 17, 'angle': 114.0, 'blen': 1.31,
                   'charge': -0.5709, 'type': 'NB'},
            "IFIXC,IOMIT,ISYMDU,IPOS": ['CORRECT', 'NOMIT', 'DU', 'BEG'],
            "N1": {'torsion': 180.0, 'tree': 'B', 'NC': 17, 'NB': 18, 'NA': 19, 'I': 21, 'angle': 111.38, 'blen': 1.4,
                   'charge': -0.4787, 'type': 'NA'},
            "loopList": [["C1'", "C2'"], ['C4', 'C5'], ['C4', 'N9']],
            "H21": {'torsion': -0.82, 'tree': 'E', 'NC': 21, 'NB': 23, 'NA': 24, 'I': 25, 'angle': 127.0, 'blen': 1.01,
                    'charge': 0.4364, 'type': 'H'},
            "NAMRES": "R-GUANOSINE - with 5' - OH end group and 3' - O(minus) group",
            "HO'2": {'torsion': 180.0, 'tree': 'E', 'NC': 29, 'NB': 31, 'NA': 33, 'I': 34, 'angle': 107.0, 'blen': 0.96,
                     'charge': 0.4186, 'type': 'HO'},
            "H8": {'torsion': 0.0, 'tree': 'E', 'NC': 12, 'NB': 14, 'NA': 15, 'I': 16, 'angle': 120.0, 'blen': 1.08,
                   'charge': 0.164, 'type': 'H5'},
            "H4'": {'torsion': -200.0, 'tree': 'E', 'NC': 5, 'NB': 6, 'NA': 9, 'I': 10, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.1174, 'type': 'H1'},
            "H1'": {'torsion': -240.0, 'tree': 'E', 'NC': 9, 'NB': 11, 'NA': 12, 'I': 13, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.2006, 'type': 'H2'},
            "atNameList": ['H5T', "O5'", "C5'", "H5'1", "H5'2", "C4'", "H4'", "O4'", "C1'", "H1'", 'N9', 'C8', 'H8',
                           'N7', 'C5', 'C6', 'O6', 'N1', 'H1', 'C2', 'N2', 'H21', 'H22', 'N3', 'C4', "C3'", "H3'",
                           "C2'", "H2'1", "O2'", "HO'2", "O3'"],
            "DUMM": [['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.00', '0.00', '0.00', '0.0000'],
                     ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.00', '0.00', '0.00', '0.0000'],
                     ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.00', '90.00', '0.00', '0.0000']],
            "N2": {'torsion': 180.0, 'tree': 'B', 'NC': 19, 'NB': 21, 'NA': 23, 'I': 24, 'angle': 116.02, 'blen': 1.34,
                   'charge': -0.9672, 'type': 'N2'},
            "O6": {'torsion': 0.0, 'tree': 'E', 'NC': 17, 'NB': 18, 'NA': 19, 'I': 20, 'angle': 128.8, 'blen': 1.23,
                   'charge': -0.5597, 'type': 'O'},
            "H5'2": {'torsion': -60.0, 'tree': 'E', 'NC': 4, 'NB': 5, 'NA': 6, 'I': 8, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0679, 'type': 'H1'},
            "H5'1": {'torsion': 60.0, 'tree': 'E', 'NC': 4, 'NB': 5, 'NA': 6, 'I': 7, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0679, 'type': 'H1'},
            "H3'": {'torsion': 30.0, 'tree': 'E', 'NC': 6, 'NB': 9, 'NA': 29, 'I': 30, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.0615, 'type': 'H1'},
            "C4'": {'torsion': -180.0, 'tree': 'M', 'NC': 4, 'NB': 5, 'NA': 6, 'I': 9, 'angle': 110.0, 'blen': 1.52,
                    'charge': 0.1065, 'type': 'CT'},
            "H2'1": {'torsion': 120.0, 'tree': 'E', 'NC': 9, 'NB': 29, 'NA': 31, 'I': 32, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0972, 'type': 'H1'},
            "N9": {'torsion': -127.7, 'tree': 'S', 'NC': 9, 'NB': 11, 'NA': 12, 'I': 14, 'angle': 108.06, 'blen': 1.49,
                   'charge': 0.0492, 'type': 'N*'},
            "H5T": {'torsion': 180.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 120.0, 'blen': 1.0,
                    'charge': 0.4295, 'type': 'HO'},
            "H22": {'torsion': -179.44, 'tree': 'E', 'NC': 21, 'NB': 23, 'NA': 24, 'I': 26, 'angle': 116.53,
                    'blen': 1.01, 'charge': 0.4364, 'type': 'H'},
            "C5'": {'torsion': -39.22, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 5, 'I': 6, 'angle': 119.0, 'blen': 1.44,
                    'charge': 0.0558, 'type': 'CT'},
            "C1'": {'torsion': 105.6, 'tree': 'B', 'NC': 5, 'NB': 9, 'NA': 11, 'I': 12, 'angle': 110.04, 'blen': 1.42,
                    'charge': 0.0191, 'type': 'CT'},
            "C3'": {'torsion': -329.11, 'tree': 'M', 'NC': 5, 'NB': 6, 'NA': 9, 'I': 29, 'angle': 115.78, 'blen': 1.53,
                    'charge': 0.2022, 'type': 'CT'},
            "CUT": ['0.0'],
            },
    "RUN": {"C4": {'torsion': 0.0, 'tree': 'B', 'NC': 14, 'NB': 15, 'NA': 17, 'I': 19, 'angle': 120.78, 'blen': 1.44,
                   'charge': 0.5952, 'type': 'C'},
            "C5": {'torsion': 177.3, 'tree': 'B', 'NC': 12, 'NB': 14, 'NA': 15, 'I': 17, 'angle': 121.22, 'blen': 1.34,
                   'charge': -0.3635, 'type': 'CM'},
            "C6": {'torsion': 81.59, 'tree': 'B', 'NC': 11, 'NB': 12, 'NA': 14, 'I': 15, 'angle': 123.04, 'blen': 1.37,
                   'charge': -0.1126, 'type': 'CM'},
            "O3'": {'torsion': -203.47, 'tree': 'M', 'NC': 6, 'NB': 9, 'NA': 25, 'I': 31, 'angle': 116.52, 'blen': 1.42,
                    'charge': -0.6541, 'type': 'OH'},
            "H6": {'torsion': 0.0, 'tree': 'E', 'NC': 12, 'NB': 14, 'NA': 15, 'I': 16, 'angle': 120.0, 'blen': 1.08,
                   'charge': 0.2188, 'type': 'H4'},
            "O2'": {'torsion': 240.0, 'tree': 'S', 'NC': 9, 'NB': 25, 'NA': 27, 'I': 29, 'angle': 109.5, 'blen': 1.43,
                    'charge': -0.6139, 'type': 'OH'},
            "C2": {'torsion': 0.0, 'tree': 'S', 'NC': 17, 'NB': 19, 'NA': 21, 'I': 23, 'angle': 126.46, 'blen': 1.38,
                   'charge': 0.4687, 'type': 'C'},
            "N3": {'torsion': 0.0, 'tree': 'B', 'NC': 15, 'NB': 17, 'NA': 19, 'I': 21, 'angle': 114.07, 'blen': 1.38,
                   'charge': -0.3549, 'type': 'NA'},
            "C2'": {'torsion': -86.3, 'tree': 'B', 'NC': 6, 'NB': 9, 'NA': 25, 'I': 27, 'angle': 102.8, 'blen': 1.53,
                    'charge': 0.067, 'type': 'CT'},
            "H2'1": {'torsion': 120.0, 'tree': 'E', 'NC': 9, 'NB': 25, 'NA': 27, 'I': 28, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0972, 'type': 'H1'},
            "O4'": {'torsion': -86.31, 'tree': 'S', 'NC': 5, 'NB': 6, 'NA': 9, 'I': 11, 'angle': 108.86, 'blen': 1.46,
                    'charge': -0.3548, 'type': 'OS'},
            "INTX,KFORM": ['INT', '1'],
            "O5'": {'torsion': -98.89, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 101.43, 'blen': 0.96,
                    'charge': -0.6223, 'type': 'OH'},
            "O4": {'torsion': 180.0, 'tree': 'E', 'NC': 15, 'NB': 17, 'NA': 19, 'I': 20, 'angle': 125.35, 'blen': 1.23,
                   'charge': -0.5761, 'type': 'O'},
            "H3T": {'torsion': 180.0, 'tree': 'M', 'NC': 9, 'NB': 25, 'NA': 31, 'I': 32, 'angle': 114.97, 'blen': 0.96,
                    'charge': 0.4376, 'type': 'HO'},
            "H3": {'torsion': 180.0, 'tree': 'E', 'NC': 17, 'NB': 19, 'NA': 21, 'I': 22, 'angle': 116.77, 'blen': 1.09,
                   'charge': 0.3154, 'type': 'H'},
            "IFIXC,IOMIT,ISYMDU,IPOS": ['CORRECT', 'NOMIT', 'DU', 'BEG'],
            "loopList": [["C1'", "C2'"], ['C2', 'N1']],
            "H3'": {'torsion': 30.0, 'tree': 'E', 'NC': 6, 'NB': 9, 'NA': 25, 'I': 26, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.0615, 'type': 'H1'},
            "NAMRES": "R-URACIL - with 5' - OH group and 3' - OH group",
            "HO'2": {'torsion': 180.0, 'tree': 'E', 'NC': 25, 'NB': 27, 'NA': 29, 'I': 30, 'angle': 107.0, 'blen': 0.96,
                     'charge': 0.4186, 'type': 'HO'},
            "H4'": {'torsion': -200.0, 'tree': 'E', 'NC': 5, 'NB': 6, 'NA': 9, 'I': 10, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.1174, 'type': 'H1'},
            "H1'": {'torsion': -240.0, 'tree': 'E', 'NC': 9, 'NB': 11, 'NA': 12, 'I': 13, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.1824, 'type': 'H2'},
            "O2": {'torsion': 180.0, 'tree': 'E', 'NC': 19, 'NB': 21, 'NA': 23, 'I': 24, 'angle': 121.7, 'blen': 1.22,
                   'charge': -0.5477, 'type': 'O'},
            "atNameList": ['H5T', "O5'", "C5'", "H5'1", "H5'2", "C4'", "H4'", "O4'", "C1'", "H1'", 'N1', 'C6', 'H6',
                           'C5', 'H5', 'C4', 'O4', 'N3', 'H3', 'C2', 'O2', "C3'", "H3'", "C2'", "H2'1", "O2'", "HO'2",
                           "O3'", 'H3T'],
            "DUMM": [['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.00', '0.00', '0.00', '0.0000'],
                     ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.00', '0.00', '0.00', '0.0000'],
                     ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.00', '90.00', '0.00', '0.0000']],
            "N1": {'torsion': -127.7, 'tree': 'S', 'NC': 9, 'NB': 11, 'NA': 12, 'I': 14, 'angle': 109.59, 'blen': 1.53,
                   'charge': 0.0418, 'type': 'N*'},
            "H5'2": {'torsion': -60.0, 'tree': 'E', 'NC': 4, 'NB': 5, 'NA': 6, 'I': 8, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0679, 'type': 'H1'},
            "H5'1": {'torsion': 60.0, 'tree': 'E', 'NC': 4, 'NB': 5, 'NA': 6, 'I': 7, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0679, 'type': 'H1'},
            "C4'": {'torsion': -180.0, 'tree': 'M', 'NC': 4, 'NB': 5, 'NA': 6, 'I': 9, 'angle': 110.0, 'blen': 1.52,
                    'charge': 0.1065, 'type': 'CT'},
            "H5T": {'torsion': 180.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 120.0, 'blen': 1.0,
                    'charge': 0.4295, 'type': 'HO'},
            "C5'": {'torsion': -39.22, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 5, 'I': 6, 'angle': 119.0, 'blen': 1.44,
                    'charge': 0.0558, 'type': 'CT'},
            "C1'": {'torsion': 105.6, 'tree': 'B', 'NC': 6, 'NB': 9, 'NA': 11, 'I': 12, 'angle': 110.04, 'blen': 1.42,
                    'charge': 0.0674, 'type': 'CT'},
            "C3'": {'torsion': -329.11, 'tree': 'M', 'NC': 5, 'NB': 6, 'NA': 9, 'I': 25, 'angle': 115.78, 'blen': 1.53,
                    'charge': 0.2022, 'type': 'CT'},
            "H5": {'torsion': 180.0, 'tree': 'E', 'NC': 14, 'NB': 15, 'NA': 17, 'I': 18, 'angle': 120.0, 'blen': 1.09,
                   'charge': 0.1811, 'type': 'HA'},
            "CUT": ['0.0'],
            "impropTors": [['C6', 'C2', 'N1', "C1'"], ['C4', 'C6', 'C5', 'H5'], ['N1', 'N3', 'C2', 'O2'],
                           ['C5', 'N3', 'C4', 'O4'], ['C2', 'C4', 'N3', 'H3'], ['N1', 'C5', 'C6', 'H6']],
            },
    "RG3": {"C4": {'torsion': 0.0, 'tree': 'E', 'NC': 23, 'NB': 25, 'NA': 29, 'I': 30, 'angle': 112.2, 'blen': 1.36,
                   'charge': 0.1222, 'type': 'CB'},
            "C5": {'torsion': 0.0, 'tree': 'S', 'NC': 16, 'NB': 17, 'NA': 19, 'I': 20, 'angle': 103.9, 'blen': 1.39,
                   'charge': 0.1744, 'type': 'CB'},
            "C6": {'torsion': 180.0, 'tree': 'B', 'NC': 17, 'NB': 19, 'NA': 20, 'I': 21, 'angle': 130.4, 'blen': 1.42,
                   'charge': 0.477, 'type': 'C'},
            "O3'": {'torsion': -203.47, 'tree': 'M', 'NC': 8, 'NB': 11, 'NA': 31, 'I': 37, 'angle': 116.52,
                    'blen': 1.42, 'charge': -0.6541, 'type': 'OH'},
            "O2'": {'torsion': 240.0, 'tree': 'S', 'NC': 11, 'NB': 31, 'NA': 33, 'I': 35, 'angle': 109.5, 'blen': 1.43,
                    'charge': -0.6139, 'type': 'OH'},
            "impropTors": [['C8', 'C4', 'N9', "C1'"], ['C5', 'N1', 'C6', 'O6'], ['C6', 'C2', 'N1', 'H1'],
                           ['C2', 'H21', 'N2', 'H22'], ['N7', 'N9', 'C8', 'H8'], ['N1', 'N3', 'C2', 'N2']],
            "C2": {'torsion': -0.1, 'tree': 'B', 'NC': 20, 'NB': 21, 'NA': 23, 'I': 25, 'angle': 125.24, 'blen': 1.38,
                   'charge': 0.7657, 'type': 'CA'},
            "N3": {'torsion': 0.0, 'tree': 'S', 'NC': 21, 'NB': 23, 'NA': 25, 'I': 29, 'angle': 123.3, 'blen': 1.33,
                   'charge': -0.6323, 'type': 'NC'},
            "P": {'torsion': 200.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 119.04, 'blen': 1.6,
                  'charge': 1.1662, 'type': 'P'},
            "H1": {'torsion': 179.9, 'tree': 'E', 'NC': 20, 'NB': 21, 'NA': 23, 'I': 24, 'angle': 117.36, 'blen': 1.0,
                   'charge': 0.3424, 'type': 'H'},
            "C8": {'torsion': 81.59, 'tree': 'B', 'NC': 13, 'NB': 14, 'NA': 16, 'I': 17, 'angle': 129.2, 'blen': 1.38,
                   'charge': 0.1374, 'type': 'CK'},
            "O4'": {'torsion': -86.31, 'tree': 'S', 'NC': 7, 'NB': 8, 'NA': 11, 'I': 13, 'angle': 108.86, 'blen': 1.46,
                    'charge': -0.3548, 'type': 'OS'},
            "INTX,KFORM": ['INT', '1'],
            "O5'": {'torsion': -98.89, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 7, 'angle': 101.43, 'blen': 1.6,
                    'charge': -0.4989, 'type': 'OS'},
            "N7": {'torsion': -179.9, 'tree': 'S', 'NC': 14, 'NB': 16, 'NA': 17, 'I': 19, 'angle': 114.0, 'blen': 1.31,
                   'charge': -0.5709, 'type': 'NB'},
            "H3T": {'torsion': 180.0, 'tree': 'M', 'NC': 11, 'NB': 31, 'NA': 37, 'I': 38, 'angle': 114.97, 'blen': 0.96,
                    'charge': 0.4376, 'type': 'HO'},
            "IFIXC,IOMIT,ISYMDU,IPOS": ['CORRECT', 'OMIT', 'DU', 'BEG'],
            "N1": {'torsion': 180.0, 'tree': 'B', 'NC': 19, 'NB': 20, 'NA': 21, 'I': 23, 'angle': 111.38, 'blen': 1.4,
                   'charge': -0.4787, 'type': 'NA'},
            "loopList": [["C1'", "C2'"], ['C4', 'C5'], ['C4', 'N9']],
            "H21": {'torsion': -0.82, 'tree': 'E', 'NC': 23, 'NB': 25, 'NA': 26, 'I': 27, 'angle': 127.0, 'blen': 1.01,
                    'charge': 0.4364, 'type': 'H'},
            "NAMRES": "R-GUANOSINE - with 5' - phosphate group and 3' - OH group",
            "HO'2": {'torsion': 180.0, 'tree': 'E', 'NC': 31, 'NB': 33, 'NA': 35, 'I': 36, 'angle': 107.0, 'blen': 0.96,
                     'charge': 0.4186, 'type': 'HO'},
            "H8": {'torsion': 0.0, 'tree': 'E', 'NC': 14, 'NB': 16, 'NA': 17, 'I': 18, 'angle': 120.0, 'blen': 1.08,
                   'charge': 0.164, 'type': 'H5'},
            "H4'": {'torsion': -200.0, 'tree': 'E', 'NC': 7, 'NB': 8, 'NA': 11, 'I': 12, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.1174, 'type': 'H1'},
            "H1'": {'torsion': -240.0, 'tree': 'E', 'NC': 11, 'NB': 13, 'NA': 14, 'I': 15, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.2006, 'type': 'H2'},
            "atNameList": ['P', 'O1P', 'O2P', "O5'", "C5'", "H5'1", "H5'2", "C4'", "H4'", "O4'", "C1'", "H1'", 'N9',
                           'C8', 'H8', 'N7', 'C5', 'C6', 'O6', 'N1', 'H1', 'C2', 'N2', 'H21', 'H22', 'N3', 'C4', "C3'",
                           "H3'", "C2'", "H2'1", "O2'", "HO'2", "O3'", 'H3T'],
            "DUMM": [['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.00', '0.00', '0.00', '0.0000'],
                     ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.00', '0.00', '0.00', '0.0000'],
                     ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.00', '90.00', '0.00', '0.0000']],
            "N2": {'torsion': 180.0, 'tree': 'B', 'NC': 21, 'NB': 23, 'NA': 25, 'I': 26, 'angle': 116.02, 'blen': 1.34,
                   'charge': -0.9672, 'type': 'N2'},
            "O6": {'torsion': 0.0, 'tree': 'E', 'NC': 19, 'NB': 20, 'NA': 21, 'I': 22, 'angle': 128.8, 'blen': 1.23,
                   'charge': -0.5597, 'type': 'O'},
            "C2'": {'torsion': -86.3, 'tree': 'B', 'NC': 8, 'NB': 11, 'NA': 31, 'I': 33, 'angle': 102.8, 'blen': 1.53,
                    'charge': 0.067, 'type': 'CT'},
            "H5'2": {'torsion': -60.0, 'tree': 'E', 'NC': 4, 'NB': 7, 'NA': 8, 'I': 10, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0679, 'type': 'H1'},
            "H5'1": {'torsion': 60.0, 'tree': 'E', 'NC': 4, 'NB': 7, 'NA': 8, 'I': 9, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0679, 'type': 'H1'},
            "H3'": {'torsion': 30.0, 'tree': 'E', 'NC': 8, 'NB': 11, 'NA': 31, 'I': 32, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.0615, 'type': 'H1'},
            "C4'": {'torsion': 180.0, 'tree': 'M', 'NC': 4, 'NB': 7, 'NA': 8, 'I': 11, 'angle': 110.0, 'blen': 1.52,
                    'charge': 0.1065, 'type': 'CT'},
            "H2'1": {'torsion': 120.0, 'tree': 'E', 'NC': 11, 'NB': 31, 'NA': 33, 'I': 34, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0972, 'type': 'H1'},
            "N9": {'torsion': -127.7, 'tree': 'S', 'NC': 11, 'NB': 13, 'NA': 14, 'I': 16, 'angle': 108.06, 'blen': 1.49,
                   'charge': 0.0492, 'type': 'N*'},
            "C5'": {'torsion': -39.22, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 7, 'I': 8, 'angle': 119.0, 'blen': 1.44,
                    'charge': 0.0558, 'type': 'CT'},
            "H22": {'torsion': -179.44, 'tree': 'E', 'NC': 23, 'NB': 25, 'NA': 26, 'I': 28, 'angle': 116.53,
                    'blen': 1.01, 'charge': 0.4364, 'type': 'H'},
            "O2P": {'torsion': 20.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 6, 'angle': 109.58, 'blen': 1.48,
                    'charge': -0.776, 'type': 'O2'},
            "C1'": {'torsion': 105.6, 'tree': 'B', 'NC': 8, 'NB': 11, 'NA': 13, 'I': 14, 'angle': 110.04, 'blen': 1.42,
                    'charge': 0.0191, 'type': 'CT'},
            "C3'": {'torsion': -329.11, 'tree': 'M', 'NC': 7, 'NB': 8, 'NA': 11, 'I': 31, 'angle': 115.78, 'blen': 1.53,
                    'charge': 0.2022, 'type': 'CT'},
            "O1P": {'torsion': 150.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 109.61, 'blen': 1.48,
                    'charge': -0.776, 'type': 'O2'},
            "CUT": ['0.0'],
            },
    "RU": {"C4": {'torsion': 0.0, 'tree': 'B', 'NC': 16, 'NB': 17, 'NA': 19, 'I': 21, 'angle': 120.78, 'blen': 1.44,
                  'charge': 0.5952, 'type': 'C'},
           "C5": {'torsion': 177.3, 'tree': 'B', 'NC': 14, 'NB': 16, 'NA': 17, 'I': 19, 'angle': 121.22, 'blen': 1.34,
                  'charge': -0.3635, 'type': 'CM'},
           "C6": {'torsion': 81.59, 'tree': 'B', 'NC': 13, 'NB': 14, 'NA': 16, 'I': 17, 'angle': 123.04, 'blen': 1.37,
                  'charge': -0.1126, 'type': 'CM'},
           "O3'": {'torsion': -203.47, 'tree': 'M', 'NC': 8, 'NB': 11, 'NA': 27, 'I': 33, 'angle': 116.52, 'blen': 1.42,
                   'charge': -0.5246, 'type': 'OS'},
           "H6": {'torsion': 0.0, 'tree': 'E', 'NC': 14, 'NB': 16, 'NA': 17, 'I': 18, 'angle': 120.0, 'blen': 1.08,
                  'charge': 0.2188, 'type': 'H4'},
           "O2'": {'torsion': 240.0, 'tree': 'S', 'NC': 11, 'NB': 27, 'NA': 29, 'I': 31, 'angle': 109.5, 'blen': 1.43,
                   'charge': -0.6139, 'type': 'OH'},
           "C2": {'torsion': 0.0, 'tree': 'S', 'NC': 19, 'NB': 21, 'NA': 23, 'I': 25, 'angle': 126.46, 'blen': 1.38,
                  'charge': 0.4687, 'type': 'C'},
           "N3": {'torsion': 0.0, 'tree': 'B', 'NC': 17, 'NB': 19, 'NA': 21, 'I': 23, 'angle': 114.07, 'blen': 1.38,
                  'charge': -0.3549, 'type': 'NA'},
           "C2'": {'torsion': -86.3, 'tree': 'B', 'NC': 8, 'NB': 11, 'NA': 27, 'I': 29, 'angle': 102.8, 'blen': 1.53,
                   'charge': 0.067, 'type': 'CT'},
           "H2'1": {'torsion': 120.0, 'tree': 'E', 'NC': 11, 'NB': 27, 'NA': 29, 'I': 30, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.0972, 'type': 'H1'},
           "O4'": {'torsion': -86.31, 'tree': 'S', 'NC': 7, 'NB': 8, 'NA': 11, 'I': 13, 'angle': 108.86, 'blen': 1.46,
                   'charge': -0.3548, 'type': 'OS'},
           "INTX,KFORM": ['INT', '1'],
           "O5'": {'torsion': -98.89, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 7, 'angle': 101.43, 'blen': 1.6,
                   'charge': -0.4989, 'type': 'OS'},
           "O4": {'torsion': 180.0, 'tree': 'E', 'NC': 17, 'NB': 19, 'NA': 21, 'I': 22, 'angle': 125.35, 'blen': 1.23,
                  'charge': -0.5761, 'type': 'O'},
           "H3": {'torsion': 180.0, 'tree': 'E', 'NC': 19, 'NB': 21, 'NA': 23, 'I': 24, 'angle': 116.77, 'blen': 1.09,
                  'charge': 0.3154, 'type': 'H'},
           "IFIXC,IOMIT,ISYMDU,IPOS": ['CORRECT', 'OMIT', 'DU', 'BEG'],
           "loopList": [["C1'", "C2'"], ['C2', 'N1']],
           "H3'": {'torsion': 30.0, 'tree': 'E', 'NC': 8, 'NB': 11, 'NA': 27, 'I': 28, 'angle': 109.5, 'blen': 1.09,
                   'charge': 0.0615, 'type': 'H1'},
           "NAMRES": "R-URACIL - with 5' - phosphate group and 3' - O(minus) group",
           "HO'2": {'torsion': 180.0, 'tree': 'E', 'NC': 27, 'NB': 29, 'NA': 31, 'I': 32, 'angle': 107.0, 'blen': 0.96,
                    'charge': 0.4186, 'type': 'HO'},
           "H4'": {'torsion': -200.0, 'tree': 'E', 'NC': 7, 'NB': 8, 'NA': 11, 'I': 12, 'angle': 109.5, 'blen': 1.09,
                   'charge': 0.1174, 'type': 'H1'},
           "H1'": {'torsion': -240.0, 'tree': 'E', 'NC': 11, 'NB': 13, 'NA': 14, 'I': 15, 'angle': 109.5, 'blen': 1.09,
                   'charge': 0.1824, 'type': 'H2'},
           "O2": {'torsion': 180.0, 'tree': 'E', 'NC': 21, 'NB': 23, 'NA': 25, 'I': 26, 'angle': 121.7, 'blen': 1.22,
                  'charge': -0.5477, 'type': 'O'},
           "atNameList": ['P', 'O1P', 'O2P', "O5'", "C5'", "H5'1", "H5'2", "C4'", "H4'", "O4'", "C1'", "H1'", 'N1',
                          'C6', 'H6', 'C5', 'H5', 'C4', 'O4', 'N3', 'H3', 'C2', 'O2', "C3'", "H3'", "C2'", "H2'1",
                          "O2'", "HO'2", "O3'"],
           "DUMM": [['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.00', '0.00', '0.00', '0.0000'],
                    ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.00', '0.00', '0.00', '0.0000'],
                    ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.00', '90.00', '0.00', '0.0000']],
           "N1": {'torsion': -127.7, 'tree': 'S', 'NC': 11, 'NB': 13, 'NA': 14, 'I': 16, 'angle': 109.59, 'blen': 1.53,
                  'charge': 0.0418, 'type': 'N*'},
           "H5'2": {'torsion': -60.0, 'tree': 'E', 'NC': 4, 'NB': 7, 'NA': 8, 'I': 10, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.0679, 'type': 'H1'},
           "H5'1": {'torsion': 60.0, 'tree': 'E', 'NC': 4, 'NB': 7, 'NA': 8, 'I': 9, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.0679, 'type': 'H1'},
           "C4'": {'torsion': 180.0, 'tree': 'M', 'NC': 4, 'NB': 7, 'NA': 8, 'I': 11, 'angle': 110.0, 'blen': 1.52,
                   'charge': 0.1065, 'type': 'CT'},
           "P": {'torsion': 200.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 119.04, 'blen': 1.6,
                 'charge': 1.1662, 'type': 'P'},
           "C5'": {'torsion': -39.22, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 7, 'I': 8, 'angle': 119.0, 'blen': 1.44,
                   'charge': 0.0558, 'type': 'CT'},
           "O2P": {'torsion': 20.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 6, 'angle': 109.58, 'blen': 1.48,
                   'charge': -0.776, 'type': 'O2'},
           "C1'": {'torsion': 105.6, 'tree': 'B', 'NC': 8, 'NB': 11, 'NA': 13, 'I': 14, 'angle': 110.04, 'blen': 1.42,
                   'charge': 0.0674, 'type': 'CT'},
           "C3'": {'torsion': -329.11, 'tree': 'M', 'NC': 7, 'NB': 8, 'NA': 11, 'I': 27, 'angle': 115.78, 'blen': 1.53,
                   'charge': 0.2022, 'type': 'CT'},
           "H5": {'torsion': 180.0, 'tree': 'E', 'NC': 16, 'NB': 17, 'NA': 19, 'I': 20, 'angle': 120.0, 'blen': 1.09,
                  'charge': 0.1811, 'type': 'HA'},
           "O1P": {'torsion': 150.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 109.61, 'blen': 1.48,
                   'charge': -0.776, 'type': 'O2'},
           "CUT": ['0.0'],
           "impropTors": [['C6', 'C2', 'N1', "C1'"], ['C4', 'C6', 'C5', 'H5'], ['N1', 'N3', 'C2', 'O2'],
                          ['C5', 'N3', 'C4', 'O4'], ['C2', 'C4', 'N3', 'H3'], ['N1', 'C5', 'C6', 'H6']],
           },
    "DCN": {"C4": {'torsion': 0.0, 'tree': 'B', 'NC': 14, 'NB': 15, 'NA': 17, 'I': 19, 'angle': 116.9, 'blen': 1.43,
                   'charge': 0.8439, 'type': 'CA'},
            "C5": {'torsion': 180.0, 'tree': 'B', 'NC': 12, 'NB': 14, 'NA': 15, 'I': 17, 'angle': 121.0, 'blen': 1.36,
                   'charge': -0.5222, 'type': 'CM'},
            "C6": {'torsion': 81.59, 'tree': 'B', 'NC': 11, 'NB': 12, 'NA': 14, 'I': 15, 'angle': 121.1, 'blen': 1.36,
                   'charge': -0.0183, 'type': 'CM'},
            "O3'": {'torsion': -203.47, 'tree': 'M', 'NC': 6, 'NB': 9, 'NA': 26, 'I': 31, 'angle': 116.52, 'blen': 1.42,
                    'charge': -0.6549, 'type': 'OH'},
            "H6": {'torsion': 0.0, 'tree': 'E', 'NC': 12, 'NB': 14, 'NA': 15, 'I': 16, 'angle': 120.0, 'blen': 1.08,
                   'charge': 0.2293, 'type': 'H4'},
            "impropTors": [['C6', 'C2', 'N1', "C1'"], ['N1', 'N3', 'C2', 'O2'], ['C4', 'H41', 'N4', 'H42'],
                           ['N1', 'C5', 'C6', 'H6'], ['C6', 'C4', 'C5', 'H5'], ['N3', 'C5', 'C4', 'N4']],
            "C2": {'torsion': 0.0, 'tree': 'S', 'NC': 17, 'NB': 19, 'NA': 23, 'I': 24, 'angle': 120.5, 'blen': 1.36,
                   'charge': 0.7959, 'type': 'C'},
            "H41": {'torsion': 180.0, 'tree': 'E', 'NC': 17, 'NB': 19, 'NA': 20, 'I': 21, 'angle': 117.7, 'blen': 1.01,
                    'charge': 0.4314, 'type': 'H'},
            "H42": {'torsion': 0.0, 'tree': 'E', 'NC': 17, 'NB': 19, 'NA': 20, 'I': 22, 'angle': 120.27, 'blen': 1.01,
                    'charge': 0.4314, 'type': 'H'},
            "H2'2": {'torsion': 240.0, 'tree': 'E', 'NC': 9, 'NB': 26, 'NA': 28, 'I': 30, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0718, 'type': 'HC'},
            "O4'": {'torsion': -86.31, 'tree': 'S', 'NC': 5, 'NB': 6, 'NA': 9, 'I': 11, 'angle': 108.86, 'blen': 1.46,
                    'charge': -0.3691, 'type': 'OS'},
            "INTX,KFORM": ['INT', '1'],
            "O5'": {'torsion': -98.89, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 101.43, 'blen': 0.96,
                    'charge': -0.6318, 'type': 'OH'},
            "N3": {'torsion': 0.0, 'tree': 'S', 'NC': 15, 'NB': 17, 'NA': 19, 'I': 23, 'angle': 121.7, 'blen': 1.33,
                   'charge': -0.7748, 'type': 'NC'},
            "H3T": {'torsion': 180.0, 'tree': 'M', 'NC': 9, 'NB': 26, 'NA': 31, 'I': 32, 'angle': 114.97, 'blen': 0.96,
                    'charge': 0.4396, 'type': 'HO'},
            "IFIXC,IOMIT,ISYMDU,IPOS": ['CORRECT', 'NOMIT', 'DU', 'BEG'],
            "loopList": [["C1'", "C2'"], ['C2', 'N1']],
            "N4": {'torsion': 180.0, 'tree': 'B', 'NC': 15, 'NB': 17, 'NA': 19, 'I': 20, 'angle': 120.1, 'blen': 1.32,
                   'charge': -0.9773, 'type': 'N2'},
            "NAMRES": "D-CYTOSINE - with 5' - OH group and 3' - OH group",
            "H4'": {'torsion': -200.0, 'tree': 'E', 'NC': 5, 'NB': 6, 'NA': 9, 'I': 10, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.1176, 'type': 'H1'},
            "H1'": {'torsion': -240.0, 'tree': 'E', 'NC': 9, 'NB': 11, 'NA': 12, 'I': 13, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.1963, 'type': 'H2'},
            "O2": {'torsion': 180.0, 'tree': 'E', 'NC': 19, 'NB': 23, 'NA': 24, 'I': 25, 'angle': 122.4, 'blen': 1.24,
                   'charge': -0.6548, 'type': 'O'},
            "atNameList": ['H5T', "O5'", "C5'", "H5'1", "H5'2", "C4'", "H4'", "O4'", "C1'", "H1'", 'N1', 'C6', 'H6',
                           'C5', 'H5', 'C4', 'N4', 'H41', 'H42', 'N3', 'C2', 'O2', "C3'", "H3'", "C2'", "H2'1", "H2'2",
                           "O3'", 'H3T'],
            "DUMM": [['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.00', '0.00', '0.00', '0.0000'],
                     ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.00', '0.00', '0.00', '0.0000'],
                     ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.00', '90.00', '0.00', '0.0000']],
            "H2'1": {'torsion': 120.0, 'tree': 'E', 'NC': 9, 'NB': 26, 'NA': 28, 'I': 29, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0718, 'type': 'HC'},
            "N1": {'torsion': -127.7, 'tree': 'S', 'NC': 9, 'NB': 11, 'NA': 12, 'I': 14, 'angle': 108.1, 'blen': 1.49,
                   'charge': -0.0339, 'type': 'N*'},
            "C2'": {'torsion': -86.3, 'tree': 'B', 'NC': 6, 'NB': 9, 'NA': 26, 'I': 28, 'angle': 102.8, 'blen': 1.53,
                    'charge': -0.0854, 'type': 'CT'},
            "H5'2": {'torsion': -60.0, 'tree': 'E', 'NC': 4, 'NB': 5, 'NA': 6, 'I': 8, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0754, 'type': 'H1'},
            "H5'1": {'torsion': 60.0, 'tree': 'E', 'NC': 4, 'NB': 5, 'NA': 6, 'I': 7, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0754, 'type': 'H1'},
            "H3'": {'torsion': 30.0, 'tree': 'E', 'NC': 6, 'NB': 9, 'NA': 26, 'I': 27, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.0985, 'type': 'H1'},
            "C4'": {'torsion': -180.0, 'tree': 'M', 'NC': 4, 'NB': 5, 'NA': 6, 'I': 9, 'angle': 110.0, 'blen': 1.52,
                    'charge': 0.1629, 'type': 'CT'},
            "H5T": {'torsion': 180.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 120.0, 'blen': 1.0,
                    'charge': 0.4422, 'type': 'HO'},
            "C5'": {'torsion': -39.22, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 5, 'I': 6, 'angle': 119.0, 'blen': 1.44,
                    'charge': -0.0069, 'type': 'CT'},
            "C1'": {'torsion': 105.6, 'tree': 'B', 'NC': 5, 'NB': 9, 'NA': 11, 'I': 12, 'angle': 110.04, 'blen': 1.42,
                    'charge': -0.0116, 'type': 'CT'},
            "C3'": {'torsion': -329.11, 'tree': 'M', 'NC': 5, 'NB': 6, 'NA': 9, 'I': 26, 'angle': 115.78, 'blen': 1.53,
                    'charge': 0.0713, 'type': 'CT'},
            "H5": {'torsion': 180.0, 'tree': 'E', 'NC': 14, 'NB': 15, 'NA': 17, 'I': 18, 'angle': 120.0, 'blen': 1.09,
                   'charge': 0.1863, 'type': 'HA'},
            "CUT": ['0.0'],
            },
    "RU5": {"C4": {'torsion': 0.0, 'tree': 'B', 'NC': 14, 'NB': 15, 'NA': 17, 'I': 19, 'angle': 120.78, 'blen': 1.44,
                   'charge': 0.5952, 'type': 'C'},
            "C5": {'torsion': 177.3, 'tree': 'B', 'NC': 12, 'NB': 14, 'NA': 15, 'I': 17, 'angle': 121.22, 'blen': 1.34,
                   'charge': -0.3635, 'type': 'CM'},
            "C6": {'torsion': 81.59, 'tree': 'B', 'NC': 11, 'NB': 12, 'NA': 14, 'I': 15, 'angle': 123.04, 'blen': 1.37,
                   'charge': -0.1126, 'type': 'CM'},
            "O3'": {'torsion': -203.47, 'tree': 'M', 'NC': 6, 'NB': 9, 'NA': 25, 'I': 31, 'angle': 116.52, 'blen': 1.42,
                    'charge': -0.5246, 'type': 'OS'},
            "H6": {'torsion': 0.0, 'tree': 'E', 'NC': 12, 'NB': 14, 'NA': 15, 'I': 16, 'angle': 120.0, 'blen': 1.08,
                   'charge': 0.2188, 'type': 'H4'},
            "O2'": {'torsion': 240.0, 'tree': 'S', 'NC': 9, 'NB': 25, 'NA': 27, 'I': 29, 'angle': 109.5, 'blen': 1.43,
                    'charge': -0.6139, 'type': 'OH'},
            "C2": {'torsion': 0.0, 'tree': 'S', 'NC': 17, 'NB': 19, 'NA': 21, 'I': 23, 'angle': 126.46, 'blen': 1.38,
                   'charge': 0.4687, 'type': 'C'},
            "N3": {'torsion': 0.0, 'tree': 'B', 'NC': 15, 'NB': 17, 'NA': 19, 'I': 21, 'angle': 114.07, 'blen': 1.38,
                   'charge': -0.3549, 'type': 'NA'},
            "C2'": {'torsion': -86.3, 'tree': 'B', 'NC': 6, 'NB': 9, 'NA': 25, 'I': 27, 'angle': 102.8, 'blen': 1.53,
                    'charge': 0.067, 'type': 'CT'},
            "H2'1": {'torsion': 120.0, 'tree': 'E', 'NC': 9, 'NB': 25, 'NA': 27, 'I': 28, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0972, 'type': 'H1'},
            "O4'": {'torsion': -86.31, 'tree': 'S', 'NC': 5, 'NB': 6, 'NA': 9, 'I': 11, 'angle': 108.86, 'blen': 1.46,
                    'charge': -0.3548, 'type': 'OS'},
            "INTX,KFORM": ['INT', '1'],
            "O5'": {'torsion': -98.89, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 101.43, 'blen': 0.96,
                    'charge': -0.6223, 'type': 'OH'},
            "O4": {'torsion': 180.0, 'tree': 'E', 'NC': 15, 'NB': 17, 'NA': 19, 'I': 20, 'angle': 125.35, 'blen': 1.23,
                   'charge': -0.5761, 'type': 'O'},
            "H3": {'torsion': 180.0, 'tree': 'E', 'NC': 17, 'NB': 19, 'NA': 21, 'I': 22, 'angle': 116.77, 'blen': 1.09,
                   'charge': 0.3154, 'type': 'H'},
            "IFIXC,IOMIT,ISYMDU,IPOS": ['CORRECT', 'NOMIT', 'DU', 'BEG'],
            "loopList": [["C1'", "C2'"], ['C2', 'N1']],
            "H3'": {'torsion': 30.0, 'tree': 'E', 'NC': 6, 'NB': 9, 'NA': 25, 'I': 26, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.0615, 'type': 'H1'},
            "NAMRES": "R-URACIL - with 5' - OH end group and 3' - O(minus)",
            "HO'2": {'torsion': 180.0, 'tree': 'E', 'NC': 25, 'NB': 27, 'NA': 29, 'I': 30, 'angle': 107.0, 'blen': 0.96,
                     'charge': 0.4186, 'type': 'HO'},
            "H4'": {'torsion': -200.0, 'tree': 'E', 'NC': 5, 'NB': 6, 'NA': 9, 'I': 10, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.1174, 'type': 'H1'},
            "H1'": {'torsion': -240.0, 'tree': 'E', 'NC': 9, 'NB': 11, 'NA': 12, 'I': 13, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.1824, 'type': 'H2'},
            "O2": {'torsion': 180.0, 'tree': 'E', 'NC': 19, 'NB': 21, 'NA': 23, 'I': 24, 'angle': 121.7, 'blen': 1.22,
                   'charge': -0.5477, 'type': 'O'},
            "atNameList": ['H5T', "O5'", "C5'", "H5'1", "H5'2", "C4'", "H4'", "O4'", "C1'", "H1'", 'N1', 'C6', 'H6',
                           'C5', 'H5', 'C4', 'O4', 'N3', 'H3', 'C2', 'O2', "C3'", "H3'", "C2'", "H2'1", "O2'", "HO'2",
                           "O3'"],
            "DUMM": [['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.00', '0.00', '0.00', '0.0000'],
                     ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.00', '0.00', '0.00', '0.0000'],
                     ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.00', '90.00', '0.00', '0.0000']],
            "N1": {'torsion': -127.7, 'tree': 'S', 'NC': 9, 'NB': 11, 'NA': 12, 'I': 14, 'angle': 109.59, 'blen': 1.53,
                   'charge': 0.0418, 'type': 'N*'},
            "H5'2": {'torsion': -60.0, 'tree': 'E', 'NC': 4, 'NB': 5, 'NA': 6, 'I': 8, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0679, 'type': 'H1'},
            "H5'1": {'torsion': 60.0, 'tree': 'E', 'NC': 4, 'NB': 5, 'NA': 6, 'I': 7, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0679, 'type': 'H1'},
            "C4'": {'torsion': -180.0, 'tree': 'M', 'NC': 4, 'NB': 5, 'NA': 6, 'I': 9, 'angle': 110.0, 'blen': 1.52,
                    'charge': 0.1065, 'type': 'CT'},
            "H5T": {'torsion': 180.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 120.0, 'blen': 1.0,
                    'charge': 0.4295, 'type': 'HO'},
            "C5'": {'torsion': -39.22, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 5, 'I': 6, 'angle': 119.0, 'blen': 1.44,
                    'charge': 0.0558, 'type': 'CT'},
            "C1'": {'torsion': 105.6, 'tree': 'B', 'NC': 6, 'NB': 9, 'NA': 11, 'I': 12, 'angle': 110.04, 'blen': 1.42,
                    'charge': 0.0674, 'type': 'CT'},
            "C3'": {'torsion': -329.11, 'tree': 'M', 'NC': 5, 'NB': 6, 'NA': 9, 'I': 25, 'angle': 115.78, 'blen': 1.53,
                    'charge': 0.2022, 'type': 'CT'},
            "H5": {'torsion': 180.0, 'tree': 'E', 'NC': 14, 'NB': 15, 'NA': 17, 'I': 18, 'angle': 120.0, 'blen': 1.09,
                   'charge': 0.1811, 'type': 'HA'},
            "CUT": ['0.0'],
            "impropTors": [['C6', 'C2', 'N1', "C1'"], ['C4', 'C6', 'C5', 'H5'], ['N1', 'N3', 'C2', 'O2'],
                           ['C5', 'N3', 'C4', 'O4'], ['C2', 'C4', 'N3', 'H3'], ['N1', 'C5', 'C6', 'H6']],
            },
    "RGN": {"C4": {'torsion': 0.0, 'tree': 'E', 'NC': 21, 'NB': 23, 'NA': 27, 'I': 28, 'angle': 112.2, 'blen': 1.36,
                   'charge': 0.1222, 'type': 'CB'},
            "C5": {'torsion': 0.0, 'tree': 'S', 'NC': 14, 'NB': 15, 'NA': 17, 'I': 18, 'angle': 103.9, 'blen': 1.39,
                   'charge': 0.1744, 'type': 'CB'},
            "C6": {'torsion': 180.0, 'tree': 'B', 'NC': 15, 'NB': 17, 'NA': 18, 'I': 19, 'angle': 130.4, 'blen': 1.42,
                   'charge': 0.477, 'type': 'C'},
            "O3'": {'torsion': -203.47, 'tree': 'M', 'NC': 6, 'NB': 9, 'NA': 29, 'I': 35, 'angle': 116.52, 'blen': 1.42,
                    'charge': -0.6541, 'type': 'OH'},
            "O2'": {'torsion': 240.0, 'tree': 'S', 'NC': 9, 'NB': 29, 'NA': 31, 'I': 33, 'angle': 109.5, 'blen': 1.43,
                    'charge': -0.6139, 'type': 'OH'},
            "impropTors": [['C8', 'C4', 'N9', "C1'"], ['C5', 'N1', 'C6', 'O6'], ['C6', 'C2', 'N1', 'H1'],
                           ['C2', 'H21', 'N2', 'H22'], ['N7', 'N9', 'C8', 'H8'], ['N1', 'N3', 'C2', 'N2']],
            "C2": {'torsion': -0.1, 'tree': 'B', 'NC': 18, 'NB': 19, 'NA': 21, 'I': 23, 'angle': 125.24, 'blen': 1.38,
                   'charge': 0.7657, 'type': 'CA'},
            "N3": {'torsion': 0.0, 'tree': 'S', 'NC': 19, 'NB': 21, 'NA': 23, 'I': 27, 'angle': 123.3, 'blen': 1.33,
                   'charge': -0.6323, 'type': 'NC'},
            "C2'": {'torsion': -86.3, 'tree': 'B', 'NC': 6, 'NB': 9, 'NA': 29, 'I': 31, 'angle': 102.8, 'blen': 1.53,
                    'charge': 0.067, 'type': 'CT'},
            "H1": {'torsion': 179.9, 'tree': 'E', 'NC': 18, 'NB': 19, 'NA': 21, 'I': 22, 'angle': 117.36, 'blen': 1.0,
                   'charge': 0.3424, 'type': 'H'},
            "C8": {'torsion': 81.59, 'tree': 'B', 'NC': 11, 'NB': 12, 'NA': 14, 'I': 15, 'angle': 129.2, 'blen': 1.38,
                   'charge': 0.1374, 'type': 'CK'},
            "O4'": {'torsion': -86.31, 'tree': 'S', 'NC': 5, 'NB': 6, 'NA': 9, 'I': 11, 'angle': 108.86, 'blen': 1.46,
                    'charge': -0.3548, 'type': 'OS'},
            "INTX,KFORM": ['INT', '1'],
            "O5'": {'torsion': -98.89, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 101.43, 'blen': 0.96,
                    'charge': -0.6223, 'type': 'OH'},
            "N7": {'torsion': -179.9, 'tree': 'S', 'NC': 12, 'NB': 14, 'NA': 15, 'I': 17, 'angle': 114.0, 'blen': 1.31,
                   'charge': -0.5709, 'type': 'NB'},
            "H3T": {'torsion': 180.0, 'tree': 'M', 'NC': 9, 'NB': 29, 'NA': 35, 'I': 36, 'angle': 114.97, 'blen': 0.96,
                    'charge': 0.4376, 'type': 'HO'},
            "IFIXC,IOMIT,ISYMDU,IPOS": ['CORRECT', 'NOMIT', 'DU', 'BEG'],
            "N1": {'torsion': 180.0, 'tree': 'B', 'NC': 17, 'NB': 18, 'NA': 19, 'I': 21, 'angle': 111.38, 'blen': 1.4,
                   'charge': -0.4787, 'type': 'NA'},
            "loopList": [["C1'", "C2'"], ['C4', 'C5'], ['C4', 'N9']],
            "H21": {'torsion': -0.82, 'tree': 'E', 'NC': 21, 'NB': 23, 'NA': 24, 'I': 25, 'angle': 127.0, 'blen': 1.01,
                    'charge': 0.4364, 'type': 'H'},
            "NAMRES": "R-GUANOSINE - with 5' - OH group and 3' - OH group",
            "HO'2": {'torsion': 180.0, 'tree': 'E', 'NC': 29, 'NB': 31, 'NA': 33, 'I': 34, 'angle': 107.0, 'blen': 0.96,
                     'charge': 0.4186, 'type': 'HO'},
            "H8": {'torsion': 0.0, 'tree': 'E', 'NC': 12, 'NB': 14, 'NA': 15, 'I': 16, 'angle': 120.0, 'blen': 1.08,
                   'charge': 0.164, 'type': 'H5'},
            "H4'": {'torsion': -200.0, 'tree': 'E', 'NC': 5, 'NB': 6, 'NA': 9, 'I': 10, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.1174, 'type': 'H1'},
            "H1'": {'torsion': -240.0, 'tree': 'E', 'NC': 9, 'NB': 11, 'NA': 12, 'I': 13, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.2006, 'type': 'H2'},
            "atNameList": ['H5T', "O5'", "C5'", "H5'1", "H5'2", "C4'", "H4'", "O4'", "C1'", "H1'", 'N9', 'C8', 'H8',
                           'N7', 'C5', 'C6', 'O6', 'N1', 'H1', 'C2', 'N2', 'H21', 'H22', 'N3', 'C4', "C3'", "H3'",
                           "C2'", "H2'1", "O2'", "HO'2", "O3'", 'H3T'],
            "DUMM": [['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.00', '0.00', '0.00', '0.0000'],
                     ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.00', '0.00', '0.00', '0.0000'],
                     ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.00', '90.00', '0.00', '0.0000']],
            "N2": {'torsion': 180.0, 'tree': 'B', 'NC': 19, 'NB': 21, 'NA': 23, 'I': 24, 'angle': 116.02, 'blen': 1.34,
                   'charge': -0.9672, 'type': 'N2'},
            "O6": {'torsion': 0.0, 'tree': 'E', 'NC': 17, 'NB': 18, 'NA': 19, 'I': 20, 'angle': 128.8, 'blen': 1.23,
                   'charge': -0.5597, 'type': 'O'},
            "H5'2": {'torsion': -60.0, 'tree': 'E', 'NC': 4, 'NB': 5, 'NA': 6, 'I': 8, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0679, 'type': 'H1'},
            "H5'1": {'torsion': 60.0, 'tree': 'E', 'NC': 4, 'NB': 5, 'NA': 6, 'I': 7, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0679, 'type': 'H1'},
            "H3'": {'torsion': 30.0, 'tree': 'E', 'NC': 6, 'NB': 9, 'NA': 29, 'I': 30, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.0615, 'type': 'H1'},
            "C4'": {'torsion': -180.0, 'tree': 'M', 'NC': 4, 'NB': 5, 'NA': 6, 'I': 9, 'angle': 110.0, 'blen': 1.52,
                    'charge': 0.1065, 'type': 'CT'},
            "H2'1": {'torsion': 120.0, 'tree': 'E', 'NC': 9, 'NB': 29, 'NA': 31, 'I': 32, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0972, 'type': 'H1'},
            "N9": {'torsion': -127.7, 'tree': 'S', 'NC': 9, 'NB': 11, 'NA': 12, 'I': 14, 'angle': 108.06, 'blen': 1.49,
                   'charge': 0.0492, 'type': 'N*'},
            "H5T": {'torsion': 180.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 120.0, 'blen': 1.0,
                    'charge': 0.4295, 'type': 'HO'},
            "H22": {'torsion': -179.44, 'tree': 'E', 'NC': 21, 'NB': 23, 'NA': 24, 'I': 26, 'angle': 116.53,
                    'blen': 1.01, 'charge': 0.4364, 'type': 'H'},
            "C5'": {'torsion': -39.22, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 5, 'I': 6, 'angle': 119.0, 'blen': 1.44,
                    'charge': 0.0558, 'type': 'CT'},
            "C1'": {'torsion': 105.6, 'tree': 'B', 'NC': 5, 'NB': 9, 'NA': 11, 'I': 12, 'angle': 110.04, 'blen': 1.42,
                    'charge': 0.0191, 'type': 'CT'},
            "C3'": {'torsion': -329.11, 'tree': 'M', 'NC': 5, 'NB': 6, 'NA': 9, 'I': 29, 'angle': 115.78, 'blen': 1.53,
                    'charge': 0.2022, 'type': 'CT'},
            "CUT": ['0.0'],
            },
    "DC3": {"C4": {'torsion': 0.0, 'tree': 'B', 'NC': 16, 'NB': 17, 'NA': 19, 'I': 21, 'angle': 116.9, 'blen': 1.43,
                   'charge': 0.8439, 'type': 'CA'},
            "C5": {'torsion': 180.0, 'tree': 'B', 'NC': 14, 'NB': 16, 'NA': 17, 'I': 19, 'angle': 121.0, 'blen': 1.36,
                   'charge': -0.5222, 'type': 'CM'},
            "C6": {'torsion': 81.59, 'tree': 'B', 'NC': 13, 'NB': 14, 'NA': 16, 'I': 17, 'angle': 121.1, 'blen': 1.36,
                   'charge': -0.0183, 'type': 'CM'},
            "O3'": {'torsion': -203.47, 'tree': 'M', 'NC': 8, 'NB': 11, 'NA': 28, 'I': 33, 'angle': 116.52,
                    'blen': 1.42, 'charge': -0.6549, 'type': 'OH'},
            "H6": {'torsion': 0.0, 'tree': 'E', 'NC': 14, 'NB': 16, 'NA': 17, 'I': 18, 'angle': 120.0, 'blen': 1.08,
                   'charge': 0.2293, 'type': 'H4'},
            "impropTors": [['C6', 'C2', 'N1', "C1'"], ['N1', 'N3', 'C2', 'O2'], ['C4', 'H41', 'N4', 'H42'],
                           ['N1', 'C5', 'C6', 'H6'], ['C6', 'C4', 'C5', 'H5'], ['N3', 'C5', 'C4', 'N4']],
            "C2": {'torsion': 0.0, 'tree': 'S', 'NC': 19, 'NB': 21, 'NA': 25, 'I': 26, 'angle': 120.5, 'blen': 1.36,
                   'charge': 0.7959, 'type': 'C'},
            "H41": {'torsion': 180.0, 'tree': 'E', 'NC': 19, 'NB': 21, 'NA': 22, 'I': 23, 'angle': 117.7, 'blen': 1.01,
                    'charge': 0.4314, 'type': 'H'},
            "H42": {'torsion': 0.0, 'tree': 'E', 'NC': 19, 'NB': 21, 'NA': 22, 'I': 24, 'angle': 120.27, 'blen': 1.01,
                    'charge': 0.4314, 'type': 'H'},
            "H2'2": {'torsion': 240.0, 'tree': 'E', 'NC': 11, 'NB': 28, 'NA': 30, 'I': 32, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0718, 'type': 'HC'},
            "O4'": {'torsion': -86.31, 'tree': 'S', 'NC': 7, 'NB': 8, 'NA': 11, 'I': 13, 'angle': 108.86, 'blen': 1.46,
                    'charge': -0.3691, 'type': 'OS'},
            "INTX,KFORM": ['INT', '1'],
            "O5'": {'torsion': -98.89, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 7, 'angle': 101.43, 'blen': 1.6,
                    'charge': -0.4954, 'type': 'OS'},
            "N3": {'torsion': 0.0, 'tree': 'S', 'NC': 17, 'NB': 19, 'NA': 21, 'I': 25, 'angle': 121.7, 'blen': 1.33,
                   'charge': -0.7748, 'type': 'NC'},
            "H3T": {'torsion': 180.0, 'tree': 'M', 'NC': 8, 'NB': 25, 'NA': 30, 'I': 34, 'angle': 114.97, 'blen': 0.96,
                    'charge': 0.4396, 'type': 'HO'},
            "IFIXC,IOMIT,ISYMDU,IPOS": ['CORRECT', 'OMIT', 'DU', 'BEG'],
            "loopList": [["C1'", "C2'"], ['C2', 'N1']],
            "N4": {'torsion': 180.0, 'tree': 'B', 'NC': 17, 'NB': 19, 'NA': 21, 'I': 22, 'angle': 120.1, 'blen': 1.32,
                   'charge': -0.9773, 'type': 'N2'},
            "NAMRES": "D-CYTOSINE - with 5' - phosphate group and 3' - OH group",
            "H4'": {'torsion': -200.0, 'tree': 'E', 'NC': 7, 'NB': 8, 'NA': 11, 'I': 12, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.1176, 'type': 'H1'},
            "H1'": {'torsion': -240.0, 'tree': 'E', 'NC': 11, 'NB': 13, 'NA': 14, 'I': 15, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.1963, 'type': 'H2'},
            "O2": {'torsion': 180.0, 'tree': 'E', 'NC': 21, 'NB': 25, 'NA': 26, 'I': 27, 'angle': 122.4, 'blen': 1.24,
                   'charge': -0.6548, 'type': 'O'},
            "atNameList": ['P', 'O1P', 'O2P', "O5'", "C5'", "H5'1", "H5'2", "C4'", "H4'", "O4'", "C1'", "H1'", 'N1',
                           'C6', 'H6', 'C5', 'H5', 'C4', 'N4', 'H41', 'H42', 'N3', 'C2', 'O2', "C3'", "H3'", "C2'",
                           "H2'1", "H2'2", "O3'", 'H3T'],
            "DUMM": [['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.00', '0.00', '0.00', '0.0000'],
                     ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.00', '0.00', '0.00', '0.0000'],
                     ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.00', '90.00', '0.00', '0.0000']],
            "H2'1": {'torsion': 120.0, 'tree': 'E', 'NC': 11, 'NB': 28, 'NA': 30, 'I': 31, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0718, 'type': 'HC'},
            "N1": {'torsion': -127.7, 'tree': 'S', 'NC': 11, 'NB': 13, 'NA': 14, 'I': 16, 'angle': 108.1, 'blen': 1.49,
                   'charge': -0.0339, 'type': 'N*'},
            "C2'": {'torsion': -86.3, 'tree': 'B', 'NC': 8, 'NB': 11, 'NA': 28, 'I': 30, 'angle': 102.8, 'blen': 1.53,
                    'charge': -0.0854, 'type': 'CT'},
            "H5'2": {'torsion': -60.0, 'tree': 'E', 'NC': 4, 'NB': 7, 'NA': 8, 'I': 10, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0754, 'type': 'H1'},
            "H5'1": {'torsion': 60.0, 'tree': 'E', 'NC': 4, 'NB': 7, 'NA': 8, 'I': 9, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0754, 'type': 'H1'},
            "H3'": {'torsion': 30.0, 'tree': 'E', 'NC': 8, 'NB': 11, 'NA': 28, 'I': 29, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.0985, 'type': 'H1'},
            "C4'": {'torsion': 180.0, 'tree': 'M', 'NC': 4, 'NB': 7, 'NA': 8, 'I': 11, 'angle': 110.0, 'blen': 1.52,
                    'charge': 0.1629, 'type': 'CT'},
            "P": {'torsion': 200.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 119.04, 'blen': 1.6,
                  'charge': 1.1659, 'type': 'P'},
            "C5'": {'torsion': -39.22, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 7, 'I': 8, 'angle': 119.0, 'blen': 1.44,
                    'charge': -0.0069, 'type': 'CT'},
            "O2P": {'torsion': 20.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 6, 'angle': 109.58, 'blen': 1.48,
                    'charge': -0.7761, 'type': 'O2'},
            "C1'": {'torsion': 105.6, 'tree': 'B', 'NC': 8, 'NB': 11, 'NA': 13, 'I': 14, 'angle': 110.04, 'blen': 1.42,
                    'charge': -0.0116, 'type': 'CT'},
            "C3'": {'torsion': -329.11, 'tree': 'M', 'NC': 7, 'NB': 8, 'NA': 11, 'I': 28, 'angle': 115.78, 'blen': 1.53,
                    'charge': 0.0713, 'type': 'CT'},
            "H5": {'torsion': 180.0, 'tree': 'E', 'NC': 16, 'NB': 17, 'NA': 19, 'I': 20, 'angle': 120.0, 'blen': 1.09,
                   'charge': 0.1863, 'type': 'HA'},
            "O1P": {'torsion': 150.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 109.61, 'blen': 1.48,
                    'charge': -0.7761, 'type': 'O2'},
            "CUT": ['0.0'],
            },
    "DC5": {"C4": {'torsion': 0.0, 'tree': 'B', 'NC': 14, 'NB': 15, 'NA': 17, 'I': 19, 'angle': 116.9, 'blen': 1.43,
                   'charge': 0.8439, 'type': 'CA'},
            "C5": {'torsion': 180.0, 'tree': 'B', 'NC': 12, 'NB': 14, 'NA': 15, 'I': 17, 'angle': 121.0, 'blen': 1.36,
                   'charge': -0.5222, 'type': 'CM'},
            "C6": {'torsion': 81.59, 'tree': 'B', 'NC': 11, 'NB': 12, 'NA': 14, 'I': 15, 'angle': 121.1, 'blen': 1.36,
                   'charge': -0.0183, 'type': 'CM'},
            "O3'": {'torsion': -203.47, 'tree': 'M', 'NC': 6, 'NB': 9, 'NA': 26, 'I': 31, 'angle': 116.52, 'blen': 1.42,
                    'charge': -0.5232, 'type': 'OS'},
            "H6": {'torsion': 0.0, 'tree': 'E', 'NC': 12, 'NB': 14, 'NA': 15, 'I': 16, 'angle': 120.0, 'blen': 1.08,
                   'charge': 0.2293, 'type': 'H4'},
            "impropTors": [['C6', 'C2', 'N1', "C1'"], ['N1', 'N3', 'C2', 'O2'], ['C4', 'H41', 'N4', 'H42'],
                           ['N1', 'C5', 'C6', 'H6'], ['C6', 'C4', 'C5', 'H5'], ['N3', 'C5', 'C4', 'N4']],
            "C2": {'torsion': 0.0, 'tree': 'S', 'NC': 17, 'NB': 19, 'NA': 23, 'I': 24, 'angle': 120.5, 'blen': 1.36,
                   'charge': 0.7959, 'type': 'C'},
            "H41": {'torsion': 180.0, 'tree': 'E', 'NC': 17, 'NB': 19, 'NA': 20, 'I': 21, 'angle': 117.7, 'blen': 1.01,
                    'charge': 0.4314, 'type': 'H'},
            "H42": {'torsion': 0.0, 'tree': 'E', 'NC': 17, 'NB': 19, 'NA': 20, 'I': 22, 'angle': 120.27, 'blen': 1.01,
                    'charge': 0.4314, 'type': 'H'},
            "H2'2": {'torsion': 240.0, 'tree': 'E', 'NC': 9, 'NB': 26, 'NA': 28, 'I': 30, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0718, 'type': 'HC'},
            "O4'": {'torsion': -86.31, 'tree': 'S', 'NC': 5, 'NB': 6, 'NA': 9, 'I': 11, 'angle': 108.86, 'blen': 1.46,
                    'charge': -0.3691, 'type': 'OS'},
            "INTX,KFORM": ['INT', '1'],
            "O5'": {'torsion': -98.89, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 101.43, 'blen': 0.96,
                    'charge': -0.6318, 'type': 'OH'},
            "N3": {'torsion': 0.0, 'tree': 'S', 'NC': 15, 'NB': 17, 'NA': 19, 'I': 23, 'angle': 121.7, 'blen': 1.33,
                   'charge': -0.7748, 'type': 'NC'},
            "IFIXC,IOMIT,ISYMDU,IPOS": ['CORRECT', 'NOMIT', 'DU', 'BEG'],
            "loopList": [["C1'", "C2'"], ['C2', 'N1']],
            "N4": {'torsion': 180.0, 'tree': 'B', 'NC': 15, 'NB': 17, 'NA': 19, 'I': 20, 'angle': 120.1, 'blen': 1.32,
                   'charge': -0.9773, 'type': 'N2'},
            "NAMRES": "D-CYTOSINE - with 5' - OH end group and 3' - O(minus) group",
            "H4'": {'torsion': -200.0, 'tree': 'E', 'NC': 5, 'NB': 6, 'NA': 9, 'I': 10, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.1176, 'type': 'H1'},
            "H1'": {'torsion': -240.0, 'tree': 'E', 'NC': 9, 'NB': 11, 'NA': 12, 'I': 13, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.1963, 'type': 'H2'},
            "O2": {'torsion': 180.0, 'tree': 'E', 'NC': 19, 'NB': 23, 'NA': 24, 'I': 25, 'angle': 122.4, 'blen': 1.24,
                   'charge': -0.6548, 'type': 'O'},
            "atNameList": ['H5T', "O5'", "C5'", "H5'1", "H5'2", "C4'", "H4'", "O4'", "C1'", "H1'", 'N1', 'C6', 'H6',
                           'C5', 'H5', 'C4', 'N4', 'H41', 'H42', 'N3', 'C2', 'O2', "C3'", "H3'", "C2'", "H2'1", "H2'2",
                           "O3'"],
            "DUMM": [['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.00', '0.00', '0.00', '0.0000'],
                     ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.00', '0.00', '0.00', '0.0000'],
                     ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.00', '90.00', '0.00', '0.0000']],
            "H2'1": {'torsion': 120.0, 'tree': 'E', 'NC': 9, 'NB': 26, 'NA': 28, 'I': 29, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0718, 'type': 'HC'},
            "N1": {'torsion': -127.7, 'tree': 'S', 'NC': 9, 'NB': 11, 'NA': 12, 'I': 14, 'angle': 108.1, 'blen': 1.49,
                   'charge': -0.0339, 'type': 'N*'},
            "C2'": {'torsion': -86.3, 'tree': 'B', 'NC': 6, 'NB': 9, 'NA': 26, 'I': 28, 'angle': 102.8, 'blen': 1.53,
                    'charge': -0.0854, 'type': 'CT'},
            "H5'2": {'torsion': -60.0, 'tree': 'E', 'NC': 4, 'NB': 5, 'NA': 6, 'I': 8, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0754, 'type': 'H1'},
            "H5'1": {'torsion': 60.0, 'tree': 'E', 'NC': 4, 'NB': 5, 'NA': 6, 'I': 7, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0754, 'type': 'H1'},
            "H3'": {'torsion': 30.0, 'tree': 'E', 'NC': 6, 'NB': 9, 'NA': 26, 'I': 27, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.0985, 'type': 'H1'},
            "C4'": {'torsion': -180.0, 'tree': 'M', 'NC': 4, 'NB': 5, 'NA': 6, 'I': 9, 'angle': 110.0, 'blen': 1.52,
                    'charge': 0.1629, 'type': 'CT'},
            "H5T": {'torsion': 180.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 120.0, 'blen': 1.0,
                    'charge': 0.4422, 'type': 'HO'},
            "C5'": {'torsion': -39.22, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 5, 'I': 6, 'angle': 119.0, 'blen': 1.44,
                    'charge': -0.0069, 'type': 'CT'},
            "C1'": {'torsion': 105.6, 'tree': 'B', 'NC': 5, 'NB': 9, 'NA': 11, 'I': 12, 'angle': 110.04, 'blen': 1.42,
                    'charge': -0.0116, 'type': 'CT'},
            "C3'": {'torsion': -329.11, 'tree': 'M', 'NC': 5, 'NB': 6, 'NA': 9, 'I': 26, 'angle': 115.78, 'blen': 1.53,
                    'charge': 0.0713, 'type': 'CT'},
            "H5": {'torsion': 180.0, 'tree': 'E', 'NC': 14, 'NB': 15, 'NA': 17, 'I': 18, 'angle': 120.0, 'blen': 1.09,
                   'charge': 0.1863, 'type': 'HA'},
            "CUT": ['0.0'],
            },
    "DT": {"H71": {'torsion': 60.0, 'tree': 'E', 'NC': 17, 'NB': 19, 'NA': 20, 'I': 21, 'angle': 109.5, 'blen': 1.09,
                   'charge': 0.077, 'type': 'HC'},
           "C5": {'torsion': 177.3, 'tree': 'B', 'NC': 14, 'NB': 16, 'NA': 17, 'I': 19, 'angle': 121.22, 'blen': 1.34,
                  'charge': 0.0025, 'type': 'CM'},
           "C6": {'torsion': 81.59, 'tree': 'B', 'NC': 13, 'NB': 14, 'NA': 16, 'I': 17, 'angle': 123.04, 'blen': 1.37,
                  'charge': -0.2209, 'type': 'CM'},
           "C7": {'torsion': 180.0, 'tree': '3', 'NC': 16, 'NB': 17, 'NA': 19, 'I': 20, 'angle': 121.63, 'blen': 1.5,
                  'charge': -0.2269, 'type': 'CT'},
           "H6": {'torsion': 0.0, 'tree': 'E', 'NC': 14, 'NB': 16, 'NA': 17, 'I': 18, 'angle': 120.0, 'blen': 1.08,
                  'charge': 0.2607, 'type': 'H4'},
           "O3'": {'torsion': -203.47, 'tree': 'M', 'NC': 8, 'NB': 11, 'NA': 30, 'I': 35, 'angle': 116.52, 'blen': 1.42,
                   'charge': -0.5232, 'type': 'OS'},
           "C2": {'torsion': 0.0, 'tree': 'S', 'NC': 19, 'NB': 24, 'NA': 26, 'I': 28, 'angle': 126.46, 'blen': 1.38,
                  'charge': 0.5677, 'type': 'C'},
           "N3": {'torsion': 0.0, 'tree': 'B', 'NC': 17, 'NB': 19, 'NA': 24, 'I': 26, 'angle': 114.07, 'blen': 1.38,
                  'charge': -0.434, 'type': 'NA'},
           "C2'": {'torsion': -86.3, 'tree': 'B', 'NC': 8, 'NB': 11, 'NA': 30, 'I': 32, 'angle': 102.8, 'blen': 1.53,
                   'charge': -0.0854, 'type': 'CT'},
           "H2'1": {'torsion': 120.0, 'tree': 'E', 'NC': 11, 'NB': 30, 'NA': 32, 'I': 33, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.0718, 'type': 'HC'},
           "H2'2": {'torsion': 240.0, 'tree': 'E', 'NC': 11, 'NB': 30, 'NA': 32, 'I': 34, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.0718, 'type': 'HC'},
           "O4'": {'torsion': -86.31, 'tree': 'S', 'NC': 7, 'NB': 8, 'NA': 11, 'I': 13, 'angle': 108.86, 'blen': 1.46,
                   'charge': -0.3691, 'type': 'OS'},
           "INTX,KFORM": ['INT', '1'],
           "O5'": {'torsion': -98.89, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 7, 'angle': 101.43, 'blen': 1.6,
                   'charge': -0.4954, 'type': 'OS'},
           "O4": {'torsion': 180.0, 'tree': 'E', 'NC': 17, 'NB': 19, 'NA': 24, 'I': 25, 'angle': 125.35, 'blen': 1.23,
                  'charge': -0.5563, 'type': 'O'},
           "H3": {'torsion': 180.0, 'tree': 'E', 'NC': 19, 'NB': 24, 'NA': 26, 'I': 27, 'angle': 116.77, 'blen': 1.09,
                  'charge': 0.342, 'type': 'H'},
           "IFIXC,IOMIT,ISYMDU,IPOS": ['CORRECT', 'OMIT', 'DU', 'BEG'],
           "H72": {'torsion': 180.0, 'tree': 'E', 'NC': 17, 'NB': 19, 'NA': 20, 'I': 22, 'angle': 109.5, 'blen': 1.09,
                   'charge': 0.077, 'type': 'HC'},
           "H73": {'torsion': 300.0, 'tree': 'E', 'NC': 17, 'NB': 19, 'NA': 20, 'I': 23, 'angle': 109.5, 'blen': 1.09,
                   'charge': 0.077, 'type': 'HC'},
           "H3'": {'torsion': 30.0, 'tree': 'E', 'NC': 8, 'NB': 11, 'NA': 30, 'I': 31, 'angle': 109.5, 'blen': 1.09,
                   'charge': 0.0985, 'type': 'H1'},
           "NAMRES": "D-THYMINE - with 5' - phosphate group and 3' - O(minus) group",
           "H4'": {'torsion': -200.0, 'tree': 'E', 'NC': 7, 'NB': 8, 'NA': 11, 'I': 12, 'angle': 109.5, 'blen': 1.09,
                   'charge': 0.1176, 'type': 'H1'},
           "H1'": {'torsion': -240.0, 'tree': 'E', 'NC': 11, 'NB': 13, 'NA': 14, 'I': 15, 'angle': 109.5, 'blen': 1.09,
                   'charge': 0.1804, 'type': 'H2'},
           "O2": {'torsion': 180.0, 'tree': 'E', 'NC': 24, 'NB': 26, 'NA': 28, 'I': 29, 'angle': 121.7, 'blen': 1.22,
                  'charge': -0.5881, 'type': 'O'},
           "atNameList": ['P', 'O1P', 'O2P', "O5'", "C5'", "H5'1", "H5'2", "C4'", "H4'", "O4'", "C1'", "H1'", 'N1',
                          'C6', 'H6', 'C5', 'C7', 'H71', 'H72', 'H73', 'C4', 'O4', 'N3', 'H3', 'C2', 'O2', "C3'", "H3'",
                          "C2'", "H2'1", "H2'2", "O3'"],
           "DUMM": [['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.00', '0.00', '0.00', '0.0000'],
                    ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.00', '0.00', '0.00', '0.0000'],
                    ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.00', '90.00', '0.00', '0.0000']],
           "N1": {'torsion': -127.7, 'tree': 'S', 'NC': 11, 'NB': 13, 'NA': 14, 'I': 16, 'angle': 109.59, 'blen': 1.53,
                  'charge': -0.0239, 'type': 'N*'},
           "H5'2": {'torsion': -60.0, 'tree': 'E', 'NC': 4, 'NB': 7, 'NA': 8, 'I': 10, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.0754, 'type': 'H1'},
           "H5'1": {'torsion': 60.0, 'tree': 'E', 'NC': 4, 'NB': 7, 'NA': 8, 'I': 9, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.0754, 'type': 'H1'},
           "C4'": {'torsion': 180.0, 'tree': 'M', 'NC': 4, 'NB': 7, 'NA': 8, 'I': 11, 'angle': 110.0, 'blen': 1.52,
                   'charge': 0.1629, 'type': 'CT'},
           "P": {'torsion': 200.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 119.04, 'blen': 1.6,
                 'charge': 1.1659, 'type': 'P'},
           "C5'": {'torsion': -39.22, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 7, 'I': 8, 'angle': 119.0, 'blen': 1.44,
                   'charge': -0.0069, 'type': 'CT'},
           "C4": {'torsion': 0.0, 'tree': 'B', 'NC': 16, 'NB': 17, 'NA': 19, 'I': 24, 'angle': 120.78, 'blen': 1.44,
                  'charge': 0.5194, 'type': 'C'},
           "O2P": {'torsion': 20.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 6, 'angle': 109.58, 'blen': 1.48,
                   'charge': -0.7761, 'type': 'O2'},
           "C1'": {'torsion': 105.6, 'tree': 'B', 'NC': 8, 'NB': 11, 'NA': 13, 'I': 14, 'angle': 110.04, 'blen': 1.42,
                   'charge': 0.068, 'type': 'CT'},
           "C3'": {'torsion': -329.11, 'tree': 'M', 'NC': 7, 'NB': 8, 'NA': 11, 'I': 30, 'angle': 115.78, 'blen': 1.53,
                   'charge': 0.0713, 'type': 'CT'},
           "O1P": {'torsion': 150.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 109.61, 'blen': 1.48,
                   'charge': -0.7761, 'type': 'O2'},
           "loopList": [["C1'", "C2'"], ['C2', 'N1']],
           "CUT": ['0.0'],
           "impropTors": [['C6', 'C2', 'N1', "C1'"], ['C4', 'C6', 'C5', 'C7'], ['N1', 'N3', 'C2', 'O2'],
                          ['C5', 'N3', 'C4', 'O4'], ['C2', 'C4', 'N3', 'H3'], ['N1', 'C5', 'C6', 'H6']],
           },
    "RU3": {"C4": {'torsion': 0.0, 'tree': 'B', 'NC': 16, 'NB': 17, 'NA': 19, 'I': 21, 'angle': 120.78, 'blen': 1.44,
                   'charge': 0.5952, 'type': 'C'},
            "C5": {'torsion': 177.3, 'tree': 'B', 'NC': 14, 'NB': 16, 'NA': 17, 'I': 19, 'angle': 121.22, 'blen': 1.34,
                   'charge': -0.3635, 'type': 'CM'},
            "C6": {'torsion': 81.59, 'tree': 'B', 'NC': 13, 'NB': 14, 'NA': 16, 'I': 17, 'angle': 123.04, 'blen': 1.37,
                   'charge': -0.1126, 'type': 'CM'},
            "O3'": {'torsion': -203.47, 'tree': 'M', 'NC': 8, 'NB': 11, 'NA': 27, 'I': 33, 'angle': 116.52,
                    'blen': 1.42, 'charge': -0.6541, 'type': 'OH'},
            "H6": {'torsion': 0.0, 'tree': 'E', 'NC': 14, 'NB': 16, 'NA': 17, 'I': 18, 'angle': 120.0, 'blen': 1.08,
                   'charge': 0.2188, 'type': 'H4'},
            "O2'": {'torsion': 240.0, 'tree': 'S', 'NC': 11, 'NB': 27, 'NA': 29, 'I': 31, 'angle': 109.5, 'blen': 1.43,
                    'charge': -0.6139, 'type': 'OH'},
            "C2": {'torsion': 0.0, 'tree': 'S', 'NC': 19, 'NB': 21, 'NA': 23, 'I': 25, 'angle': 126.46, 'blen': 1.38,
                   'charge': 0.4687, 'type': 'C'},
            "N3": {'torsion': 0.0, 'tree': 'B', 'NC': 17, 'NB': 19, 'NA': 21, 'I': 23, 'angle': 114.07, 'blen': 1.38,
                   'charge': -0.3549, 'type': 'NA'},
            "C2'": {'torsion': -86.3, 'tree': 'B', 'NC': 8, 'NB': 11, 'NA': 27, 'I': 29, 'angle': 102.8, 'blen': 1.53,
                    'charge': 0.067, 'type': 'CT'},
            "H2'1": {'torsion': 120.0, 'tree': 'E', 'NC': 11, 'NB': 27, 'NA': 29, 'I': 30, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0972, 'type': 'H1'},
            "O4'": {'torsion': -86.31, 'tree': 'S', 'NC': 7, 'NB': 8, 'NA': 11, 'I': 13, 'angle': 108.86, 'blen': 1.46,
                    'charge': -0.3548, 'type': 'OS'},
            "INTX,KFORM": ['INT', '1'],
            "O5'": {'torsion': -98.89, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 7, 'angle': 101.43, 'blen': 1.6,
                    'charge': -0.4989, 'type': 'OS'},
            "O4": {'torsion': 180.0, 'tree': 'E', 'NC': 17, 'NB': 19, 'NA': 21, 'I': 22, 'angle': 125.35, 'blen': 1.23,
                   'charge': -0.5761, 'type': 'O'},
            "H3T": {'torsion': 180.0, 'tree': 'M', 'NC': 11, 'NB': 27, 'NA': 33, 'I': 34, 'angle': 114.97, 'blen': 0.96,
                    'charge': 0.4376, 'type': 'HO'},
            "H3": {'torsion': 180.0, 'tree': 'E', 'NC': 19, 'NB': 21, 'NA': 23, 'I': 24, 'angle': 116.77, 'blen': 1.09,
                   'charge': 0.3154, 'type': 'H'},
            "IFIXC,IOMIT,ISYMDU,IPOS": ['CORRECT', 'OMIT', 'DU', 'BEG'],
            "loopList": [["C1'", "C2'"], ['C2', 'N1']],
            "H3'": {'torsion': 30.0, 'tree': 'E', 'NC': 8, 'NB': 11, 'NA': 27, 'I': 28, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.0615, 'type': 'H1'},
            "NAMRES": "R-URACIL - with 5' - phosphate group and 3' - OH group",
            "HO'2": {'torsion': 180.0, 'tree': 'E', 'NC': 27, 'NB': 29, 'NA': 31, 'I': 32, 'angle': 107.0, 'blen': 0.96,
                     'charge': 0.4186, 'type': 'HO'},
            "H4'": {'torsion': -200.0, 'tree': 'E', 'NC': 7, 'NB': 8, 'NA': 11, 'I': 12, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.1174, 'type': 'H1'},
            "H1'": {'torsion': -240.0, 'tree': 'E', 'NC': 11, 'NB': 13, 'NA': 14, 'I': 15, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.1824, 'type': 'H2'},
            "O2": {'torsion': 180.0, 'tree': 'E', 'NC': 21, 'NB': 23, 'NA': 25, 'I': 26, 'angle': 121.7, 'blen': 1.22,
                   'charge': -0.5477, 'type': 'O'},
            "atNameList": ['P', 'O1P', 'O2P', "O5'", "C5'", "H5'1", "H5'2", "C4'", "H4'", "O4'", "C1'", "H1'", 'N1',
                           'C6', 'H6', 'C5', 'H5', 'C4', 'O4', 'N3', 'H3', 'C2', 'O2', "C3'", "H3'", "C2'", "H2'1",
                           "O2'", "HO'2", "O3'", 'H3T'],
            "DUMM": [['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.00', '0.00', '0.00', '0.0000'],
                     ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.00', '0.00', '0.00', '0.0000'],
                     ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.00', '90.00', '0.00', '0.0000']],
            "N1": {'torsion': -127.7, 'tree': 'S', 'NC': 11, 'NB': 13, 'NA': 14, 'I': 16, 'angle': 109.59, 'blen': 1.53,
                   'charge': 0.0418, 'type': 'N*'},
            "H5'2": {'torsion': -60.0, 'tree': 'E', 'NC': 4, 'NB': 7, 'NA': 8, 'I': 10, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0679, 'type': 'H1'},
            "H5'1": {'torsion': 60.0, 'tree': 'E', 'NC': 4, 'NB': 7, 'NA': 8, 'I': 9, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0679, 'type': 'H1'},
            "C4'": {'torsion': 180.0, 'tree': 'M', 'NC': 4, 'NB': 7, 'NA': 8, 'I': 11, 'angle': 110.0, 'blen': 1.52,
                    'charge': 0.1065, 'type': 'CT'},
            "P": {'torsion': 200.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 119.04, 'blen': 1.6,
                  'charge': 1.1662, 'type': 'P'},
            "C5'": {'torsion': -39.22, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 7, 'I': 8, 'angle': 119.0, 'blen': 1.44,
                    'charge': 0.0558, 'type': 'CT'},
            "O2P": {'torsion': 20.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 6, 'angle': 109.58, 'blen': 1.48,
                    'charge': -0.776, 'type': 'O2'},
            "C1'": {'torsion': 105.6, 'tree': 'B', 'NC': 8, 'NB': 11, 'NA': 13, 'I': 14, 'angle': 110.04, 'blen': 1.42,
                    'charge': 0.0674, 'type': 'CT'},
            "C3'": {'torsion': -329.11, 'tree': 'M', 'NC': 7, 'NB': 8, 'NA': 11, 'I': 27, 'angle': 115.78, 'blen': 1.53,
                    'charge': 0.2022, 'type': 'CT'},
            "H5": {'torsion': 180.0, 'tree': 'E', 'NC': 16, 'NB': 17, 'NA': 19, 'I': 20, 'angle': 120.0, 'blen': 1.09,
                   'charge': 0.1811, 'type': 'HA'},
            "O1P": {'torsion': 150.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 109.61, 'blen': 1.48,
                    'charge': -0.776, 'type': 'O2'},
            "CUT": ['0.0'],
            "impropTors": [['C6', 'C2', 'N1', "C1'"], ['C4', 'C6', 'C5', 'H5'], ['N1', 'N3', 'C2', 'O2'],
                           ['C5', 'N3', 'C4', 'O4'], ['C2', 'C4', 'N3', 'H3'], ['N1', 'C5', 'C6', 'H6']],
            },
    "DG5": {"C4": {'torsion': 0.0, 'tree': 'E', 'NC': 21, 'NB': 23, 'NA': 27, 'I': 28, 'angle': 112.2, 'blen': 1.36,
                   'charge': 0.1814, 'type': 'CB'},
            "C5": {'torsion': 0.0, 'tree': 'S', 'NC': 14, 'NB': 15, 'NA': 17, 'I': 18, 'angle': 103.9, 'blen': 1.39,
                   'charge': 0.1991, 'type': 'CB'},
            "C6": {'torsion': 180.0, 'tree': 'B', 'NC': 15, 'NB': 17, 'NA': 18, 'I': 19, 'angle': 130.4, 'blen': 1.42,
                   'charge': 0.4918, 'type': 'C'},
            "O3'": {'torsion': -203.47, 'tree': 'M', 'NC': 6, 'NB': 9, 'NA': 29, 'I': 34, 'angle': 116.52, 'blen': 1.42,
                    'charge': -0.5232, 'type': 'OS'},
            "impropTors": [['C8', 'C4', 'N9', "C1'"], ['C5', 'N1', 'C6', 'O6'], ['C6', 'C2', 'N1', 'H1'],
                           ['C2', 'H21', 'N2', 'H22'], ['N7', 'N9', 'C8', 'H8'], ['N1', 'N3', 'C2', 'N2']],
            "C2": {'torsion': -0.1, 'tree': 'B', 'NC': 18, 'NB': 19, 'NA': 21, 'I': 23, 'angle': 125.24, 'blen': 1.38,
                   'charge': 0.7432, 'type': 'CA'},
            "N3": {'torsion': 0.0, 'tree': 'S', 'NC': 19, 'NB': 21, 'NA': 23, 'I': 27, 'angle': 123.3, 'blen': 1.33,
                   'charge': -0.6636, 'type': 'NC'},
            "C2'": {'torsion': -86.3, 'tree': 'B', 'NC': 6, 'NB': 9, 'NA': 29, 'I': 31, 'angle': 102.8, 'blen': 1.53,
                    'charge': -0.0854, 'type': 'CT'},
            "H1": {'torsion': 179.9, 'tree': 'E', 'NC': 18, 'NB': 19, 'NA': 21, 'I': 22, 'angle': 117.36, 'blen': 1.0,
                   'charge': 0.352, 'type': 'H'},
            "C8": {'torsion': 81.59, 'tree': 'B', 'NC': 11, 'NB': 12, 'NA': 14, 'I': 15, 'angle': 129.2, 'blen': 1.38,
                   'charge': 0.0736, 'type': 'CK'},
            "O4'": {'torsion': -86.31, 'tree': 'S', 'NC': 5, 'NB': 6, 'NA': 9, 'I': 11, 'angle': 108.86, 'blen': 1.46,
                    'charge': -0.3691, 'type': 'OS'},
            "INTX,KFORM": ['INT', '1'],
            "O5'": {'torsion': -98.89, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 101.43, 'blen': 0.96,
                    'charge': -0.6318, 'type': 'OH'},
            "N7": {'torsion': -179.9, 'tree': 'S', 'NC': 12, 'NB': 14, 'NA': 15, 'I': 17, 'angle': 114.0, 'blen': 1.31,
                   'charge': -0.5725, 'type': 'NB'},
            "H2'2": {'torsion': 240.0, 'tree': 'E', 'NC': 9, 'NB': 29, 'NA': 31, 'I': 33, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0718, 'type': 'HC'},
            "IFIXC,IOMIT,ISYMDU,IPOS": ['CORRECT', 'NOMIT', 'DU', 'BEG'],
            "N1": {'torsion': 180.0, 'tree': 'B', 'NC': 17, 'NB': 18, 'NA': 19, 'I': 21, 'angle': 111.38, 'blen': 1.4,
                   'charge': -0.5053, 'type': 'NA'},
            "loopList": [["C1'", "C2'"], ['C4', 'C5'], ['C4', 'N9']],
            "H21": {'torsion': -0.82, 'tree': 'E', 'NC': 21, 'NB': 23, 'NA': 24, 'I': 25, 'angle': 127.0, 'blen': 1.01,
                    'charge': 0.4235, 'type': 'H'},
            "NAMRES": "D-GUANOSINE - with 5' - OH end group and 3' - O(minus) group",
            "H8": {'torsion': 0.0, 'tree': 'E', 'NC': 12, 'NB': 14, 'NA': 15, 'I': 16, 'angle': 120.0, 'blen': 1.08,
                   'charge': 0.1997, 'type': 'H5'},
            "H4'": {'torsion': -200.0, 'tree': 'E', 'NC': 5, 'NB': 6, 'NA': 9, 'I': 10, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.1176, 'type': 'H1'},
            "H1'": {'torsion': -240.0, 'tree': 'E', 'NC': 9, 'NB': 11, 'NA': 12, 'I': 13, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.1746, 'type': 'H2'},
            "atNameList": ['H5T', "O5'", "C5'", "H5'1", "H5'2", "C4'", "H4'", "O4'", "C1'", "H1'", 'N9', 'C8', 'H8',
                           'N7', 'C5', 'C6', 'O6', 'N1', 'H1', 'C2', 'N2', 'H21', 'H22', 'N3', 'C4', "C3'", "H3'",
                           "C2'", "H2'1", "H2'2", "O3'"],
            "DUMM": [['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.00', '0.00', '0.00', '0.0000'],
                     ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.00', '0.00', '0.00', '0.0000'],
                     ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.00', '90.00', '0.00', '0.0000']],
            "N2": {'torsion': 180.0, 'tree': 'B', 'NC': 19, 'NB': 21, 'NA': 23, 'I': 24, 'angle': 116.02, 'blen': 1.34,
                   'charge': -0.923, 'type': 'N2'},
            "O6": {'torsion': 0.0, 'tree': 'E', 'NC': 17, 'NB': 18, 'NA': 19, 'I': 20, 'angle': 128.8, 'blen': 1.23,
                   'charge': -0.5699, 'type': 'O'},
            "H5'2": {'torsion': -60.0, 'tree': 'E', 'NC': 4, 'NB': 5, 'NA': 6, 'I': 8, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0754, 'type': 'H1'},
            "H5'1": {'torsion': 60.0, 'tree': 'E', 'NC': 4, 'NB': 5, 'NA': 6, 'I': 7, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0754, 'type': 'H1'},
            "H3'": {'torsion': 30.0, 'tree': 'E', 'NC': 6, 'NB': 9, 'NA': 29, 'I': 30, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.0985, 'type': 'H1'},
            "C4'": {'torsion': -180.0, 'tree': 'M', 'NC': 4, 'NB': 5, 'NA': 6, 'I': 9, 'angle': 110.0, 'blen': 1.52,
                    'charge': 0.1629, 'type': 'CT'},
            "H2'1": {'torsion': 120.0, 'tree': 'E', 'NC': 9, 'NB': 29, 'NA': 31, 'I': 32, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0718, 'type': 'HC'},
            "N9": {'torsion': -127.7, 'tree': 'S', 'NC': 9, 'NB': 11, 'NA': 12, 'I': 14, 'angle': 108.06, 'blen': 1.49,
                   'charge': 0.0577, 'type': 'N*'},
            "H5T": {'torsion': 180.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 120.0, 'blen': 1.0,
                    'charge': 0.4422, 'type': 'HO'},
            "H22": {'torsion': -179.44, 'tree': 'E', 'NC': 21, 'NB': 23, 'NA': 24, 'I': 26, 'angle': 116.53,
                    'blen': 1.01, 'charge': 0.4235, 'type': 'H'},
            "C5'": {'torsion': -39.22, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 5, 'I': 6, 'angle': 119.0, 'blen': 1.44,
                    'charge': -0.0069, 'type': 'CT'},
            "C1'": {'torsion': 105.6, 'tree': 'B', 'NC': 5, 'NB': 9, 'NA': 11, 'I': 12, 'angle': 110.04, 'blen': 1.42,
                    'charge': 0.0358, 'type': 'CT'},
            "C3'": {'torsion': -329.11, 'tree': 'M', 'NC': 5, 'NB': 6, 'NA': 9, 'I': 29, 'angle': 115.78, 'blen': 1.53,
                    'charge': 0.0713, 'type': 'CT'},
            "CUT": ['0.0'],
            },
    "RA3": {"H2": {'torsion': 180.0, 'tree': 'E', 'NC': 21, 'NB': 25, 'NA': 26, 'I': 27, 'angle': 120.0, 'blen': 1.08,
                   'charge': 0.0473, 'type': 'H5'},
            "C5": {'torsion': 0.0, 'tree': 'S', 'NC': 16, 'NB': 17, 'NA': 19, 'I': 20, 'angle': 104.0, 'blen': 1.39,
                   'charge': 0.0515, 'type': 'CB'},
            "C6": {'torsion': 180.0, 'tree': 'B', 'NC': 17, 'NB': 19, 'NA': 20, 'I': 21, 'angle': 132.42, 'blen': 1.4,
                   'charge': 0.7009, 'type': 'CA'},
            "O3'": {'torsion': -203.47, 'tree': 'M', 'NC': 8, 'NB': 11, 'NA': 30, 'I': 36, 'angle': 116.52,
                    'blen': 1.42, 'charge': -0.6541, 'type': 'OH'},
            "H62": {'torsion': 0.0, 'tree': 'E', 'NC': 20, 'NB': 21, 'NA': 22, 'I': 24, 'angle': 120.0, 'blen': 1.01,
                    'charge': 0.4115, 'type': 'H'},
            "O2'": {'torsion': 240.0, 'tree': 'S', 'NC': 11, 'NB': 30, 'NA': 32, 'I': 34, 'angle': 109.5, 'blen': 1.43,
                    'charge': -0.6139, 'type': 'OH'},
            "C2": {'torsion': 0.0, 'tree': 'B', 'NC': 20, 'NB': 21, 'NA': 25, 'I': 26, 'angle': 118.8, 'blen': 1.33,
                   'charge': 0.5875, 'type': 'CQ'},
            "H61": {'torsion': 180.0, 'tree': 'E', 'NC': 20, 'NB': 21, 'NA': 22, 'I': 23, 'angle': 120.0, 'blen': 1.01,
                    'charge': 0.4115, 'type': 'H'},
            "P": {'torsion': 200.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 119.04, 'blen': 1.6,
                  'charge': 1.1662, 'type': 'P'},
            "H2'1": {'torsion': 120.0, 'tree': 'E', 'NC': 11, 'NB': 30, 'NA': 32, 'I': 33, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0972, 'type': 'H1'},
            "C8": {'torsion': 81.59, 'tree': 'B', 'NC': 13, 'NB': 14, 'NA': 16, 'I': 17, 'angle': 131.2, 'blen': 1.37,
                   'charge': 0.2006, 'type': 'CK'},
            "O4'": {'torsion': -86.31, 'tree': 'S', 'NC': 7, 'NB': 8, 'NA': 11, 'I': 13, 'angle': 108.86, 'blen': 1.46,
                    'charge': -0.3548, 'type': 'OS'},
            "INTX,KFORM": ['INT', '1'],
            "O5'": {'torsion': -98.89, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 7, 'angle': 101.43, 'blen': 1.6,
                    'charge': -0.4989, 'type': 'OS'},
            "N7": {'torsion': 177.0, 'tree': 'S', 'NC': 14, 'NB': 16, 'NA': 17, 'I': 19, 'angle': 113.93, 'blen': 1.3,
                   'charge': -0.6073, 'type': 'NB'},
            "H3T": {'torsion': 180.0, 'tree': 'M', 'NC': 11, 'NB': 30, 'NA': 36, 'I': 37, 'angle': 114.97, 'blen': 0.96,
                    'charge': 0.4376, 'type': 'HO'},
            "IFIXC,IOMIT,ISYMDU,IPOS": ['CORRECT', 'OMIT', 'DU', 'BEG'],
            "C4": {'torsion': 0.0, 'tree': 'E', 'NC': 25, 'NB': 26, 'NA': 28, 'I': 29, 'angle': 110.8, 'blen': 1.35,
                   'charge': 0.3053, 'type': 'CB'},
            "loopList": [["C1'", "C2'"], ['C4', 'C5'], ['C4', 'N9']],
            "H3'": {'torsion': 30.0, 'tree': 'E', 'NC': 8, 'NB': 11, 'NA': 30, 'I': 31, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.0615, 'type': 'H1'},
            "NAMRES": "R-ADENOSINE - with 5' - phosphate group and 3' - OH group",
            "HO'2": {'torsion': 180.0, 'tree': 'E', 'NC': 30, 'NB': 32, 'NA': 34, 'I': 35, 'angle': 107.0, 'blen': 0.96,
                     'charge': 0.4186, 'type': 'HO'},
            "H8": {'torsion': 0.0, 'tree': 'E', 'NC': 14, 'NB': 16, 'NA': 17, 'I': 18, 'angle': 120.0, 'blen': 1.08,
                   'charge': 0.1553, 'type': 'H5'},
            "H4'": {'torsion': -200.0, 'tree': 'E', 'NC': 7, 'NB': 8, 'NA': 11, 'I': 12, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.1174, 'type': 'H1'},
            "H1'": {'torsion': -240.0, 'tree': 'E', 'NC': 11, 'NB': 13, 'NA': 14, 'I': 15, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.2007, 'type': 'H2'},
            "N6": {'torsion': 0.0, 'tree': 'B', 'NC': 19, 'NB': 20, 'NA': 21, 'I': 22, 'angle': 123.5, 'blen': 1.34,
                   'charge': -0.9019, 'type': 'N2'},
            "atNameList": ['P', 'O1P', 'O2P', "O5'", "C5'", "H5'1", "H5'2", "C4'", "H4'", "O4'", "C1'", "H1'", 'N9',
                           'C8', 'H8', 'N7', 'C5', 'C6', 'N6', 'H61', 'H62', 'N1', 'C2', 'H2', 'N3', 'C4', "C3'", "H3'",
                           "C2'", "H2'1", "O2'", "HO'2", "O3'", 'H3T'],
            "DUMM": [['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.00', '0.00', '0.00', '0.0000'],
                     ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.00', '0.00', '0.00', '0.0000'],
                     ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.00', '90.00', '0.00', '0.0000']],
            "N1": {'torsion': 180.0, 'tree': 'S', 'NC': 19, 'NB': 20, 'NA': 21, 'I': 25, 'angle': 117.43, 'blen': 1.34,
                   'charge': -0.7615, 'type': 'NC'},
            "C2'": {'torsion': -86.3, 'tree': 'B', 'NC': 8, 'NB': 11, 'NA': 30, 'I': 32, 'angle': 102.8, 'blen': 1.53,
                    'charge': 0.067, 'type': 'CT'},
            "H5'2": {'torsion': -60.0, 'tree': 'E', 'NC': 4, 'NB': 7, 'NA': 8, 'I': 10, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0679, 'type': 'H1'},
            "H5'1": {'torsion': 60.0, 'tree': 'E', 'NC': 4, 'NB': 7, 'NA': 8, 'I': 9, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0679, 'type': 'H1'},
            "C4'": {'torsion': 180.0, 'tree': 'M', 'NC': 4, 'NB': 7, 'NA': 8, 'I': 11, 'angle': 110.0, 'blen': 1.52,
                    'charge': 0.1065, 'type': 'CT'},
            "N9": {'torsion': -127.7, 'tree': 'S', 'NC': 11, 'NB': 13, 'NA': 14, 'I': 16, 'angle': 109.59, 'blen': 1.52,
                   'charge': -0.0251, 'type': 'N*'},
            "C5'": {'torsion': -39.22, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 7, 'I': 8, 'angle': 119.0, 'blen': 1.44,
                    'charge': 0.0558, 'type': 'CT'},
            "O2P": {'torsion': 20.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 6, 'angle': 109.58, 'blen': 1.48,
                    'charge': -0.776, 'type': 'O2'},
            "C1'": {'torsion': 105.6, 'tree': 'B', 'NC': 8, 'NB': 11, 'NA': 13, 'I': 14, 'angle': 110.04, 'blen': 1.42,
                    'charge': 0.0394, 'type': 'CT'},
            "C3'": {'torsion': -329.11, 'tree': 'M', 'NC': 7, 'NB': 8, 'NA': 11, 'I': 30, 'angle': 115.78, 'blen': 1.53,
                    'charge': 0.2022, 'type': 'CT'},
            "N3": {'torsion': 0.0, 'tree': 'S', 'NC': 21, 'NB': 25, 'NA': 26, 'I': 28, 'angle': 129.17, 'blen': 1.32,
                   'charge': -0.6997, 'type': 'NC'},
            "O1P": {'torsion': 150.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 109.61, 'blen': 1.48,
                    'charge': -0.776, 'type': 'O2'},
            "CUT": ['0.0'],
            "impropTors": [['C8', 'C4', 'N9', "C1'"], ['C6', 'H61', 'N6', 'H62'], ['N7', 'N9', 'C8', 'H8'],
                           ['N1', 'N3', 'C2', 'H2'], ['C5', 'N1', 'C6', 'N6']],
            },
    "RA5": {"H2": {'torsion': 180.0, 'tree': 'E', 'NC': 19, 'NB': 23, 'NA': 24, 'I': 25, 'angle': 120.0, 'blen': 1.08,
                   'charge': 0.0473, 'type': 'H5'},
            "C5": {'torsion': 0.0, 'tree': 'S', 'NC': 14, 'NB': 15, 'NA': 17, 'I': 18, 'angle': 104.0, 'blen': 1.39,
                   'charge': 0.0515, 'type': 'CB'},
            "C6": {'torsion': 180.0, 'tree': 'B', 'NC': 15, 'NB': 17, 'NA': 18, 'I': 19, 'angle': 132.42, 'blen': 1.4,
                   'charge': 0.7009, 'type': 'CA'},
            "O3'": {'torsion': -203.47, 'tree': 'M', 'NC': 6, 'NB': 9, 'NA': 28, 'I': 34, 'angle': 116.52, 'blen': 1.42,
                    'charge': -0.5246, 'type': 'OS'},
            "H62": {'torsion': 0.0, 'tree': 'E', 'NC': 18, 'NB': 19, 'NA': 20, 'I': 22, 'angle': 120.0, 'blen': 1.01,
                    'charge': 0.4115, 'type': 'H'},
            "O2'": {'torsion': 240.0, 'tree': 'S', 'NC': 9, 'NB': 28, 'NA': 30, 'I': 32, 'angle': 109.5, 'blen': 1.43,
                    'charge': -0.6139, 'type': 'OH'},
            "C2": {'torsion': 0.0, 'tree': 'B', 'NC': 18, 'NB': 19, 'NA': 23, 'I': 24, 'angle': 118.8, 'blen': 1.33,
                   'charge': 0.5875, 'type': 'CQ'},
            "H61": {'torsion': 180.0, 'tree': 'E', 'NC': 18, 'NB': 19, 'NA': 20, 'I': 21, 'angle': 120.0, 'blen': 1.01,
                    'charge': 0.4115, 'type': 'H'},
            "C2'": {'torsion': -86.3, 'tree': 'B', 'NC': 6, 'NB': 9, 'NA': 28, 'I': 30, 'angle': 102.8, 'blen': 1.53,
                    'charge': 0.067, 'type': 'CT'},
            "H2'1": {'torsion': 120.0, 'tree': 'E', 'NC': 9, 'NB': 28, 'NA': 30, 'I': 31, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0972, 'type': 'H1'},
            "C8": {'torsion': 81.59, 'tree': 'B', 'NC': 11, 'NB': 12, 'NA': 14, 'I': 15, 'angle': 131.2, 'blen': 1.37,
                   'charge': 0.2006, 'type': 'CK'},
            "O4'": {'torsion': -86.31, 'tree': 'S', 'NC': 5, 'NB': 6, 'NA': 9, 'I': 11, 'angle': 108.86, 'blen': 1.46,
                    'charge': -0.3548, 'type': 'OS'},
            "INTX,KFORM": ['INT', '1'],
            "O5'": {'torsion': -98.89, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 101.43, 'blen': 0.96,
                    'charge': -0.6223, 'type': 'OH'},
            "N7": {'torsion': 177.0, 'tree': 'S', 'NC': 12, 'NB': 14, 'NA': 15, 'I': 17, 'angle': 113.93, 'blen': 1.3,
                   'charge': -0.6073, 'type': 'NB'},
            "IFIXC,IOMIT,ISYMDU,IPOS": ['CORRECT', 'NOMIT', 'DU', 'BEG'],
            "C4": {'torsion': 0.0, 'tree': 'E', 'NC': 23, 'NB': 24, 'NA': 26, 'I': 27, 'angle': 110.8, 'blen': 1.35,
                   'charge': 0.3053, 'type': 'CB'},
            "loopList": [["C1'", "C2'"], ['C4', 'C5'], ['C4', 'N9']],
            "H3'": {'torsion': 30.0, 'tree': 'E', 'NC': 6, 'NB': 9, 'NA': 28, 'I': 29, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.0615, 'type': 'H1'},
            "NAMRES": "R-ADENOSINE - with 5' - OH end group and 3' - O(minus)",
            "HO'2": {'torsion': 180.0, 'tree': 'E', 'NC': 28, 'NB': 30, 'NA': 32, 'I': 33, 'angle': 107.0, 'blen': 0.96,
                     'charge': 0.4186, 'type': 'HO'},
            "H8": {'torsion': 0.0, 'tree': 'E', 'NC': 12, 'NB': 14, 'NA': 15, 'I': 16, 'angle': 120.0, 'blen': 1.08,
                   'charge': 0.1553, 'type': 'H5'},
            "H4'": {'torsion': -200.0, 'tree': 'E', 'NC': 5, 'NB': 6, 'NA': 9, 'I': 10, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.1174, 'type': 'H1'},
            "H1'": {'torsion': -240.0, 'tree': 'E', 'NC': 9, 'NB': 11, 'NA': 12, 'I': 13, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.2007, 'type': 'H2'},
            "N6": {'torsion': 0.0, 'tree': 'B', 'NC': 17, 'NB': 18, 'NA': 19, 'I': 20, 'angle': 123.5, 'blen': 1.34,
                   'charge': -0.9019, 'type': 'N2'},
            "atNameList": ['H5T', "O5'", "C5'", "H5'1", "H5'2", "C4'", "H4'", "O4'", "C1'", "H1'", 'N9', 'C8', 'H8',
                           'N7', 'C5', 'C6', 'N6', 'H61', 'H62', 'N1', 'C2', 'H2', 'N3', 'C4', "C3'", "H3'", "C2'",
                           "H2'1", "O2'", "HO'2", "O3'"],
            "DUMM": [['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.00', '0.00', '0.00', '0.0000'],
                     ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.00', '0.00', '0.00', '0.0000'],
                     ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.00', '90.00', '0.00', '0.0000']],
            "N1": {'torsion': 180.0, 'tree': 'S', 'NC': 17, 'NB': 18, 'NA': 19, 'I': 23, 'angle': 117.43, 'blen': 1.34,
                   'charge': -0.7615, 'type': 'NC'},
            "H5'2": {'torsion': -60.0, 'tree': 'E', 'NC': 4, 'NB': 5, 'NA': 6, 'I': 8, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0679, 'type': 'H1'},
            "H5'1": {'torsion': 60.0, 'tree': 'E', 'NC': 4, 'NB': 5, 'NA': 6, 'I': 7, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0679, 'type': 'H1'},
            "C4'": {'torsion': 180.0, 'tree': 'M', 'NC': 4, 'NB': 5, 'NA': 6, 'I': 9, 'angle': 110.0, 'blen': 1.52,
                    'charge': 0.1065, 'type': 'CT'},
            "N9": {'torsion': -127.7, 'tree': 'S', 'NC': 9, 'NB': 11, 'NA': 12, 'I': 14, 'angle': 109.59, 'blen': 1.52,
                   'charge': -0.0251, 'type': 'N*'},
            "H5T": {'torsion': 180.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 120.0, 'blen': 1.0,
                    'charge': 0.4295, 'type': 'HO'},
            "C5'": {'torsion': -39.22, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 5, 'I': 6, 'angle': 119.0, 'blen': 1.44,
                    'charge': 0.0558, 'type': 'CT'},
            "C1'": {'torsion': 105.6, 'tree': 'B', 'NC': 6, 'NB': 9, 'NA': 11, 'I': 12, 'angle': 110.04, 'blen': 1.42,
                    'charge': 0.0394, 'type': 'CT'},
            "C3'": {'torsion': -329.11, 'tree': 'M', 'NC': 5, 'NB': 6, 'NA': 9, 'I': 28, 'angle': 115.78, 'blen': 1.53,
                    'charge': 0.2022, 'type': 'CT'},
            "N3": {'torsion': 0.0, 'tree': 'S', 'NC': 19, 'NB': 23, 'NA': 24, 'I': 26, 'angle': 129.17, 'blen': 1.32,
                   'charge': -0.6997, 'type': 'NC'},
            "CUT": ['0.0'],
            "impropTors": [['C8', 'C4', 'N9', "C1'"], ['C6', 'H61', 'N6', 'H62'], ['N7', 'N9', 'C8', 'H8'],
                           ['N1', 'N3', 'C2', 'H2'], ['C5', 'N1', 'C6', 'N6']],
            },
    "RCN": {"C4": {'torsion': 0.0, 'tree': 'B', 'NC': 14, 'NB': 15, 'NA': 17, 'I': 19, 'angle': 116.9, 'blen': 1.43,
                   'charge': 0.8185, 'type': 'CA'},
            "C5": {'torsion': 180.0, 'tree': 'B', 'NC': 12, 'NB': 14, 'NA': 15, 'I': 17, 'angle': 121.0, 'blen': 1.36,
                   'charge': -0.5215, 'type': 'CM'},
            "C6": {'torsion': 81.59, 'tree': 'B', 'NC': 11, 'NB': 12, 'NA': 14, 'I': 15, 'angle': 121.1, 'blen': 1.36,
                   'charge': 0.0053, 'type': 'CM'},
            "O3'": {'torsion': -203.47, 'tree': 'M', 'NC': 6, 'NB': 9, 'NA': 26, 'I': 32, 'angle': 116.52, 'blen': 1.42,
                    'charge': -0.6541, 'type': 'OH'},
            "H6": {'torsion': 0.0, 'tree': 'E', 'NC': 12, 'NB': 14, 'NA': 15, 'I': 16, 'angle': 120.0, 'blen': 1.08,
                   'charge': 0.1958, 'type': 'H4'},
            "O2'": {'torsion': 240.0, 'tree': 'S', 'NC': 9, 'NB': 26, 'NA': 28, 'I': 30, 'angle': 109.5, 'blen': 1.43,
                    'charge': -0.6139, 'type': 'OH'},
            "C2": {'torsion': 0.0, 'tree': 'S', 'NC': 17, 'NB': 19, 'NA': 23, 'I': 24, 'angle': 120.5, 'blen': 1.36,
                   'charge': 0.7538, 'type': 'C'},
            "H41": {'torsion': 180.0, 'tree': 'E', 'NC': 17, 'NB': 19, 'NA': 20, 'I': 21, 'angle': 117.7, 'blen': 1.01,
                    'charge': 0.4234, 'type': 'H'},
            "H42": {'torsion': 0.0, 'tree': 'E', 'NC': 17, 'NB': 19, 'NA': 20, 'I': 22, 'angle': 120.27, 'blen': 1.01,
                    'charge': 0.4234, 'type': 'H'},
            "O4'": {'torsion': -86.31, 'tree': 'S', 'NC': 5, 'NB': 6, 'NA': 9, 'I': 11, 'angle': 108.86, 'blen': 1.46,
                    'charge': -0.3548, 'type': 'OS'},
            "INTX,KFORM": ['INT', '1'],
            "O5'": {'torsion': -98.89, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 101.43, 'blen': 0.96,
                    'charge': -0.6223, 'type': 'OH'},
            "N3": {'torsion': 0.0, 'tree': 'S', 'NC': 15, 'NB': 17, 'NA': 19, 'I': 23, 'angle': 121.7, 'blen': 1.33,
                   'charge': -0.7584, 'type': 'NC'},
            "H3T": {'torsion': 180.0, 'tree': 'M', 'NC': 9, 'NB': 26, 'NA': 32, 'I': 33, 'angle': 114.97, 'blen': 0.96,
                    'charge': 0.4376, 'type': 'HO'},
            "IFIXC,IOMIT,ISYMDU,IPOS": ['CORRECT', 'NOMIT', 'DU', 'BEG'],
            "loopList": [["C1'", "C2'"], ['C2', 'N1']],
            "N4": {'torsion': 180.0, 'tree': 'B', 'NC': 15, 'NB': 17, 'NA': 19, 'I': 20, 'angle': 120.1, 'blen': 1.32,
                   'charge': -0.953, 'type': 'N2'},
            "NAMRES": "R-CYTOSINE - with 5' - OH group and 3' - OH group",
            "HO'2": {'torsion': 180.0, 'tree': 'E', 'NC': 26, 'NB': 28, 'NA': 30, 'I': 31, 'angle': 107.0, 'blen': 0.96,
                     'charge': 0.4186, 'type': 'HO'},
            "H4'": {'torsion': -200.0, 'tree': 'E', 'NC': 5, 'NB': 6, 'NA': 9, 'I': 10, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.1174, 'type': 'H1'},
            "H1'": {'torsion': -240.0, 'tree': 'E', 'NC': 9, 'NB': 11, 'NA': 12, 'I': 13, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.2029, 'type': 'H2'},
            "O2": {'torsion': 180.0, 'tree': 'E', 'NC': 19, 'NB': 23, 'NA': 24, 'I': 25, 'angle': 122.4, 'blen': 1.24,
                   'charge': -0.6252, 'type': 'O'},
            "atNameList": ['H5T', "O5'", "C5'", "H5'1", "H5'2", "C4'", "H4'", "O4'", "C1'", "H1'", 'N1', 'C6', 'H6',
                           'C5', 'H5', 'C4', 'N4', 'H41', 'H42', 'N3', 'C2', 'O2', "C3'", "H3'", "C2'", "H2'1", "O2'",
                           "HO'2", "O3'", 'H3T'],
            "DUMM": [['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.00', '0.00', '0.00', '0.0000'],
                     ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.00', '0.00', '0.00', '0.0000'],
                     ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.00', '90.00', '0.00', '0.0000']],
            "H2'1": {'torsion': 120.0, 'tree': 'E', 'NC': 9, 'NB': 26, 'NA': 28, 'I': 29, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0972, 'type': 'H1'},
            "N1": {'torsion': -127.7, 'tree': 'S', 'NC': 9, 'NB': 11, 'NA': 12, 'I': 14, 'angle': 108.1, 'blen': 1.49,
                   'charge': -0.0484, 'type': 'N*'},
            "C2'": {'torsion': -86.3, 'tree': 'B', 'NC': 6, 'NB': 9, 'NA': 26, 'I': 28, 'angle': 102.8, 'blen': 1.53,
                    'charge': 0.067, 'type': 'CT'},
            "H5'2": {'torsion': -60.0, 'tree': 'E', 'NC': 4, 'NB': 5, 'NA': 6, 'I': 8, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0679, 'type': 'H1'},
            "H5'1": {'torsion': 60.0, 'tree': 'E', 'NC': 4, 'NB': 5, 'NA': 6, 'I': 7, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0679, 'type': 'H1'},
            "H3'": {'torsion': 30.0, 'tree': 'E', 'NC': 6, 'NB': 9, 'NA': 26, 'I': 27, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.0615, 'type': 'H1'},
            "C4'": {'torsion': -180.0, 'tree': 'M', 'NC': 4, 'NB': 5, 'NA': 6, 'I': 9, 'angle': 110.0, 'blen': 1.52,
                    'charge': 0.1065, 'type': 'CT'},
            "H5T": {'torsion': 180.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 120.0, 'blen': 1.0,
                    'charge': 0.4295, 'type': 'HO'},
            "C5'": {'torsion': -39.22, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 5, 'I': 6, 'angle': 119.0, 'blen': 1.44,
                    'charge': 0.0558, 'type': 'CT'},
            "C1'": {'torsion': 105.6, 'tree': 'B', 'NC': 5, 'NB': 9, 'NA': 11, 'I': 12, 'angle': 110.04, 'blen': 1.42,
                    'charge': 0.0066, 'type': 'CT'},
            "C3'": {'torsion': -329.11, 'tree': 'M', 'NC': 5, 'NB': 6, 'NA': 9, 'I': 26, 'angle': 115.78, 'blen': 1.53,
                    'charge': 0.2022, 'type': 'CT'},
            "H5": {'torsion': 180.0, 'tree': 'E', 'NC': 14, 'NB': 15, 'NA': 17, 'I': 18, 'angle': 120.0, 'blen': 1.09,
                   'charge': 0.1928, 'type': 'HA'},
            "CUT": ['0.0'],
            "impropTors": [['C6', 'C2', 'N1', "C1'"], ['N1', 'N3', 'C2', 'O2'], ['C4', 'H41', 'N4', 'H42'],
                           ['N1', 'C5', 'C6', 'H6'], ['C6', 'C4', 'C5', 'H5'], ['N3', 'C5', 'C4', 'N4']],
            },
    "DG3": {"C4": {'torsion': 0.0, 'tree': 'E', 'NC': 23, 'NB': 25, 'NA': 29, 'I': 30, 'angle': 112.2, 'blen': 1.36,
                   'charge': 0.1814, 'type': 'CB'},
            "C5": {'torsion': 0.0, 'tree': 'S', 'NC': 16, 'NB': 17, 'NA': 19, 'I': 20, 'angle': 103.9, 'blen': 1.39,
                   'charge': 0.1991, 'type': 'CB'},
            "C6": {'torsion': 180.0, 'tree': 'B', 'NC': 17, 'NB': 19, 'NA': 20, 'I': 21, 'angle': 130.4, 'blen': 1.42,
                   'charge': 0.4918, 'type': 'C'},
            "O3'": {'torsion': -203.47, 'tree': 'M', 'NC': 8, 'NB': 11, 'NA': 31, 'I': 36, 'angle': 116.52,
                    'blen': 1.42, 'charge': -0.6549, 'type': 'OH'},
            "impropTors": [['C8', 'C4', 'N9', "C1'"], ['C5', 'N1', 'C6', 'O6'], ['C6', 'C2', 'N1', 'H1'],
                           ['C2', 'H21', 'N2', 'H22'], ['N7', 'N9', 'C8', 'H8'], ['N1', 'N3', 'C2', 'N2']],
            "C2": {'torsion': -0.1, 'tree': 'B', 'NC': 20, 'NB': 21, 'NA': 23, 'I': 25, 'angle': 125.24, 'blen': 1.38,
                   'charge': 0.7432, 'type': 'CA'},
            "N3": {'torsion': 0.0, 'tree': 'S', 'NC': 21, 'NB': 23, 'NA': 25, 'I': 29, 'angle': 123.3, 'blen': 1.33,
                   'charge': -0.6636, 'type': 'NC'},
            "P": {'torsion': 200.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 119.04, 'blen': 1.6,
                  'charge': 1.1659, 'type': 'P'},
            "H1": {'torsion': 179.9, 'tree': 'E', 'NC': 20, 'NB': 21, 'NA': 23, 'I': 24, 'angle': 117.36, 'blen': 1.0,
                   'charge': 0.352, 'type': 'H'},
            "C8": {'torsion': 81.59, 'tree': 'B', 'NC': 13, 'NB': 14, 'NA': 16, 'I': 17, 'angle': 129.2, 'blen': 1.38,
                   'charge': 0.0736, 'type': 'CK'},
            "O4'": {'torsion': -86.31, 'tree': 'S', 'NC': 7, 'NB': 8, 'NA': 11, 'I': 13, 'angle': 108.86, 'blen': 1.46,
                    'charge': -0.3691, 'type': 'OS'},
            "INTX,KFORM": ['INT', '1'],
            "O5'": {'torsion': -98.89, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 7, 'angle': 101.43, 'blen': 1.6,
                    'charge': -0.4954, 'type': 'OS'},
            "N7": {'torsion': -179.9, 'tree': 'S', 'NC': 14, 'NB': 16, 'NA': 17, 'I': 19, 'angle': 114.0, 'blen': 1.31,
                   'charge': -0.5725, 'type': 'NB'},
            "H3T": {'torsion': 180.0, 'tree': 'M', 'NC': 11, 'NB': 31, 'NA': 36, 'I': 37, 'angle': 114.97, 'blen': 0.96,
                    'charge': 0.4396, 'type': 'HO'},
            "H2'2": {'torsion': 240.0, 'tree': 'E', 'NC': 11, 'NB': 31, 'NA': 33, 'I': 35, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0718, 'type': 'HC'},
            "IFIXC,IOMIT,ISYMDU,IPOS": ['CORRECT', 'OMIT', 'DU', 'BEG'],
            "N1": {'torsion': 180.0, 'tree': 'B', 'NC': 19, 'NB': 20, 'NA': 21, 'I': 23, 'angle': 111.38, 'blen': 1.4,
                   'charge': -0.5053, 'type': 'NA'},
            "loopList": [["C1'", "C2'"], ['C4', 'C5'], ['C4', 'N9']],
            "H21": {'torsion': -0.82, 'tree': 'E', 'NC': 23, 'NB': 25, 'NA': 26, 'I': 27, 'angle': 127.0, 'blen': 1.01,
                    'charge': 0.4235, 'type': 'H'},
            "NAMRES": "D-GUANOSINE - with 5' - phosphate group and 3' - OH group",
            "H8": {'torsion': 0.0, 'tree': 'E', 'NC': 14, 'NB': 16, 'NA': 17, 'I': 18, 'angle': 120.0, 'blen': 1.08,
                   'charge': 0.1997, 'type': 'H5'},
            "H4'": {'torsion': -200.0, 'tree': 'E', 'NC': 7, 'NB': 8, 'NA': 11, 'I': 12, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.1176, 'type': 'H1'},
            "H1'": {'torsion': -240.0, 'tree': 'E', 'NC': 11, 'NB': 13, 'NA': 14, 'I': 15, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.1746, 'type': 'H2'},
            "atNameList": ['P', 'O1P', 'O2P', "O5'", "C5'", "H5'1", "H5'2", "C4'", "H4'", "O4'", "C1'", "H1'", 'N9',
                           'C8', 'H8', 'N7', 'C5', 'C6', 'O6', 'N1', 'H1', 'C2', 'N2', 'H21', 'H22', 'N3', 'C4', "C3'",
                           "H3'", "C2'", "H2'1", "H2'2", "O3'", 'H3T'],
            "DUMM": [['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.00', '0.00', '0.00', '0.0000'],
                     ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.00', '0.00', '0.00', '0.0000'],
                     ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.00', '90.00', '0.00', '0.0000']],
            "N2": {'torsion': 180.0, 'tree': 'B', 'NC': 21, 'NB': 23, 'NA': 25, 'I': 26, 'angle': 116.02, 'blen': 1.34,
                   'charge': -0.923, 'type': 'N2'},
            "O6": {'torsion': 0.0, 'tree': 'E', 'NC': 19, 'NB': 20, 'NA': 21, 'I': 22, 'angle': 128.8, 'blen': 1.23,
                   'charge': -0.5699, 'type': 'O'},
            "C2'": {'torsion': -86.3, 'tree': 'B', 'NC': 8, 'NB': 11, 'NA': 31, 'I': 33, 'angle': 102.8, 'blen': 1.53,
                    'charge': -0.0854, 'type': 'CT'},
            "H5'2": {'torsion': -60.0, 'tree': 'E', 'NC': 4, 'NB': 7, 'NA': 8, 'I': 10, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0754, 'type': 'H1'},
            "H5'1": {'torsion': 60.0, 'tree': 'E', 'NC': 4, 'NB': 7, 'NA': 8, 'I': 9, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0754, 'type': 'H1'},
            "H3'": {'torsion': 30.0, 'tree': 'E', 'NC': 8, 'NB': 11, 'NA': 31, 'I': 32, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.0985, 'type': 'H1'},
            "C4'": {'torsion': 180.0, 'tree': 'M', 'NC': 4, 'NB': 7, 'NA': 8, 'I': 11, 'angle': 110.0, 'blen': 1.52,
                    'charge': 0.1629, 'type': 'CT'},
            "H2'1": {'torsion': 120.0, 'tree': 'E', 'NC': 11, 'NB': 31, 'NA': 33, 'I': 34, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0718, 'type': 'HC'},
            "N9": {'torsion': -127.7, 'tree': 'S', 'NC': 11, 'NB': 13, 'NA': 14, 'I': 16, 'angle': 108.06, 'blen': 1.49,
                   'charge': 0.0577, 'type': 'N*'},
            "C5'": {'torsion': -39.22, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 7, 'I': 8, 'angle': 119.0, 'blen': 1.44,
                    'charge': -0.0069, 'type': 'CT'},
            "H22": {'torsion': -179.44, 'tree': 'E', 'NC': 23, 'NB': 25, 'NA': 26, 'I': 28, 'angle': 116.53,
                    'blen': 1.01, 'charge': 0.4235, 'type': 'H'},
            "O2P": {'torsion': 20.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 6, 'angle': 109.58, 'blen': 1.48,
                    'charge': -0.7761, 'type': 'O2'},
            "C1'": {'torsion': 105.6, 'tree': 'B', 'NC': 8, 'NB': 11, 'NA': 13, 'I': 14, 'angle': 110.04, 'blen': 1.42,
                    'charge': 0.0358, 'type': 'CT'},
            "C3'": {'torsion': -329.11, 'tree': 'M', 'NC': 7, 'NB': 8, 'NA': 11, 'I': 31, 'angle': 115.78, 'blen': 1.53,
                    'charge': 0.0713, 'type': 'CT'},
            "O1P": {'torsion': 150.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 109.61, 'blen': 1.48,
                    'charge': -0.7761, 'type': 'O2'},
            "CUT": ['0.0'],
            },
    "DA": {"H2": {'torsion': 180.0, 'tree': 'E', 'NC': 21, 'NB': 25, 'NA': 26, 'I': 27, 'angle': 120.0, 'blen': 1.08,
                  'charge': 0.0598, 'type': 'H5'},
           "C5": {'torsion': 0.0, 'tree': 'S', 'NC': 16, 'NB': 17, 'NA': 19, 'I': 20, 'angle': 104.0, 'blen': 1.39,
                  'charge': 0.0725, 'type': 'CB'},
           "C6": {'torsion': 180.0, 'tree': 'B', 'NC': 17, 'NB': 19, 'NA': 20, 'I': 21, 'angle': 132.42, 'blen': 1.4,
                  'charge': 0.6897, 'type': 'CA'},
           "O3'": {'torsion': -203.47, 'tree': 'M', 'NC': 8, 'NB': 11, 'NA': 30, 'I': 35, 'angle': 116.52, 'blen': 1.42,
                   'charge': -0.5232, 'type': 'OS'},
           "H62": {'torsion': 0.0, 'tree': 'E', 'NC': 20, 'NB': 21, 'NA': 22, 'I': 24, 'angle': 120.0, 'blen': 1.01,
                   'charge': 0.4167, 'type': 'H'},
           "impropTors": [['C8', 'C4', 'N9', "C1'"], ['C6', 'H61', 'N6', 'H62'], ['N7', 'N9', 'C8', 'H8'],
                          ['N1', 'N3', 'C2', 'H2'], ['C5', 'N1', 'C6', 'N6']],
           "C2": {'torsion': 0.0, 'tree': 'B', 'NC': 20, 'NB': 21, 'NA': 25, 'I': 26, 'angle': 118.8, 'blen': 1.33,
                  'charge': 0.5716, 'type': 'CQ'},
           "H61": {'torsion': 180.0, 'tree': 'E', 'NC': 20, 'NB': 21, 'NA': 22, 'I': 23, 'angle': 120.0, 'blen': 1.01,
                   'charge': 0.4167, 'type': 'H'},
           "P": {'torsion': 200.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 119.04, 'blen': 1.6,
                 'charge': 1.1659, 'type': 'P'},
           "H2'1": {'torsion': 120.0, 'tree': 'E', 'NC': 11, 'NB': 30, 'NA': 32, 'I': 33, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.0718, 'type': 'HC'},
           "C8": {'torsion': 81.59, 'tree': 'B', 'NC': 13, 'NB': 14, 'NA': 16, 'I': 17, 'angle': 131.2, 'blen': 1.37,
                  'charge': 0.1607, 'type': 'CK'},
           "O4'": {'torsion': -86.31, 'tree': 'S', 'NC': 7, 'NB': 8, 'NA': 11, 'I': 13, 'angle': 108.86, 'blen': 1.46,
                   'charge': -0.3691, 'type': 'OS'},
           "INTX,KFORM": ['INT', '1'],
           "O5'": {'torsion': -98.89, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 7, 'angle': 101.43, 'blen': 1.6,
                   'charge': -0.4954, 'type': 'OS'},
           "N7": {'torsion': 177.0, 'tree': 'S', 'NC': 14, 'NB': 16, 'NA': 17, 'I': 19, 'angle': 113.93, 'blen': 1.3,
                  'charge': -0.6175, 'type': 'NB'},
           "H2'2": {'torsion': 240.0, 'tree': 'E', 'NC': 11, 'NB': 30, 'NA': 32, 'I': 34, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.0718, 'type': 'HC'},
           "IFIXC,IOMIT,ISYMDU,IPOS": ['CORRECT', 'OMIT', 'DU', 'BEG'],
           "C4": {'torsion': 0.0, 'tree': 'E', 'NC': 25, 'NB': 26, 'NA': 28, 'I': 29, 'angle': 110.8, 'blen': 1.35,
                  'charge': 0.38, 'type': 'CB'},
           "loopList": [["C1'", "C2'"], ['C4', 'C5'], ['C4', 'N9']],
           "H3'": {'torsion': 30.0, 'tree': 'E', 'NC': 8, 'NB': 11, 'NA': 30, 'I': 31, 'angle': 109.5, 'blen': 1.09,
                   'charge': 0.0985, 'type': 'H1'},
           "NAMRES": "D-ADENOSINE - with 5' - phosphate group and 3' - O(minus) group",
           "H8": {'torsion': 0.0, 'tree': 'E', 'NC': 14, 'NB': 16, 'NA': 17, 'I': 18, 'angle': 120.0, 'blen': 1.08,
                  'charge': 0.1877, 'type': 'H5'},
           "H4'": {'torsion': -200.0, 'tree': 'E', 'NC': 7, 'NB': 8, 'NA': 11, 'I': 12, 'angle': 109.5, 'blen': 1.09,
                   'charge': 0.1176, 'type': 'H1'},
           "H1'": {'torsion': -240.0, 'tree': 'E', 'NC': 11, 'NB': 13, 'NA': 14, 'I': 15, 'angle': 109.5, 'blen': 1.09,
                   'charge': 0.1838, 'type': 'H2'},
           "N6": {'torsion': 0.0, 'tree': 'B', 'NC': 19, 'NB': 20, 'NA': 21, 'I': 22, 'angle': 123.5, 'blen': 1.34,
                  'charge': -0.9123, 'type': 'N2'},
           "atNameList": ['P', 'O1P', 'O2P', "O5'", "C5'", "H5'1", "H5'2", "C4'", "H4'", "O4'", "C1'", "H1'", 'N9',
                          'C8', 'H8', 'N7', 'C5', 'C6', 'N6', 'H61', 'H62', 'N1', 'C2', 'H2', 'N3', 'C4', "C3'", "H3'",
                          "C2'", "H2'1", "H2'2", "O3'"],
           "DUMM": [['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.00', '0.00', '0.00', '0.0000'],
                    ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.00', '0.00', '0.00', '0.0000'],
                    ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.00', '90.00', '0.00', '0.0000']],
           "N1": {'torsion': 180.0, 'tree': 'S', 'NC': 19, 'NB': 20, 'NA': 21, 'I': 25, 'angle': 117.43, 'blen': 1.34,
                  'charge': -0.7624, 'type': 'NC'},
           "C2'": {'torsion': -86.3, 'tree': 'B', 'NC': 8, 'NB': 11, 'NA': 30, 'I': 32, 'angle': 102.8, 'blen': 1.53,
                   'charge': -0.0854, 'type': 'CT'},
           "H5'2": {'torsion': -60.0, 'tree': 'E', 'NC': 4, 'NB': 7, 'NA': 8, 'I': 10, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.0754, 'type': 'H1'},
           "H5'1": {'torsion': 60.0, 'tree': 'E', 'NC': 4, 'NB': 7, 'NA': 8, 'I': 9, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.0754, 'type': 'H1'},
           "C4'": {'torsion': 180.0, 'tree': 'M', 'NC': 4, 'NB': 7, 'NA': 8, 'I': 11, 'angle': 110.0, 'blen': 1.52,
                   'charge': 0.1629, 'type': 'CT'},
           "N9": {'torsion': -127.7, 'tree': 'S', 'NC': 11, 'NB': 13, 'NA': 14, 'I': 16, 'angle': 109.59, 'blen': 1.52,
                  'charge': -0.0268, 'type': 'N*'},
           "C5'": {'torsion': -39.22, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 7, 'I': 8, 'angle': 119.0, 'blen': 1.44,
                   'charge': -0.0069, 'type': 'CT'},
           "O2P": {'torsion': 20.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 6, 'angle': 109.58, 'blen': 1.48,
                   'charge': -0.7761, 'type': 'O2'},
           "C1'": {'torsion': 105.6, 'tree': 'B', 'NC': 8, 'NB': 11, 'NA': 13, 'I': 14, 'angle': 110.04, 'blen': 1.42,
                   'charge': 0.0431, 'type': 'CT'},
           "C3'": {'torsion': -329.11, 'tree': 'M', 'NC': 7, 'NB': 8, 'NA': 11, 'I': 30, 'angle': 115.78, 'blen': 1.53,
                   'charge': 0.0713, 'type': 'CT'},
           "N3": {'torsion': 0.0, 'tree': 'S', 'NC': 21, 'NB': 25, 'NA': 26, 'I': 28, 'angle': 129.17, 'blen': 1.32,
                  'charge': -0.7417, 'type': 'NC'},
           "O1P": {'torsion': 150.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 109.61, 'blen': 1.48,
                   'charge': -0.7761, 'type': 'O2'},
           "CUT": ['0.0'],
           },
    "DC": {"C4": {'torsion': 0.0, 'tree': 'B', 'NC': 16, 'NB': 17, 'NA': 19, 'I': 21, 'angle': 116.9, 'blen': 1.43,
                  'charge': 0.8439, 'type': 'CA'},
           "C5": {'torsion': 180.0, 'tree': 'B', 'NC': 14, 'NB': 16, 'NA': 17, 'I': 19, 'angle': 121.0, 'blen': 1.36,
                  'charge': -0.5222, 'type': 'CM'},
           "C6": {'torsion': 81.59, 'tree': 'B', 'NC': 13, 'NB': 14, 'NA': 16, 'I': 17, 'angle': 121.1, 'blen': 1.36,
                  'charge': -0.0183, 'type': 'CM'},
           "O3'": {'torsion': -203.47, 'tree': 'M', 'NC': 8, 'NB': 11, 'NA': 28, 'I': 33, 'angle': 116.52, 'blen': 1.42,
                   'charge': -0.5232, 'type': 'OS'},
           "H6": {'torsion': 0.0, 'tree': 'E', 'NC': 14, 'NB': 16, 'NA': 17, 'I': 18, 'angle': 120.0, 'blen': 1.08,
                  'charge': 0.2293, 'type': 'H4'},
           "impropTors": [['C6', 'C2', 'N1', "C1'"], ['N1', 'N3', 'C2', 'O2'], ['C4', 'H41', 'N4', 'H42'],
                          ['N1', 'C5', 'C6', 'H6'], ['C6', 'C4', 'C5', 'H5'], ['N3', 'C5', 'C4', 'N4']],
           "C2": {'torsion': 0.0, 'tree': 'S', 'NC': 19, 'NB': 21, 'NA': 25, 'I': 26, 'angle': 120.5, 'blen': 1.36,
                  'charge': 0.7959, 'type': 'C'},
           "H41": {'torsion': 180.0, 'tree': 'E', 'NC': 19, 'NB': 21, 'NA': 22, 'I': 23, 'angle': 117.7, 'blen': 1.01,
                   'charge': 0.4314, 'type': 'H'},
           "H42": {'torsion': 0.0, 'tree': 'E', 'NC': 19, 'NB': 21, 'NA': 22, 'I': 24, 'angle': 120.27, 'blen': 1.01,
                   'charge': 0.4314, 'type': 'H'},
           "H2'2": {'torsion': 240.0, 'tree': 'E', 'NC': 11, 'NB': 28, 'NA': 30, 'I': 32, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.0718, 'type': 'HC'},
           "O4'": {'torsion': -86.31, 'tree': 'S', 'NC': 7, 'NB': 8, 'NA': 11, 'I': 13, 'angle': 108.86, 'blen': 1.46,
                   'charge': -0.3691, 'type': 'OS'},
           "INTX,KFORM": ['INT', '1'],
           "O5'": {'torsion': -98.89, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 7, 'angle': 101.43, 'blen': 1.6,
                   'charge': -0.4954, 'type': 'OS'},
           "N3": {'torsion': 0.0, 'tree': 'S', 'NC': 17, 'NB': 19, 'NA': 21, 'I': 25, 'angle': 121.7, 'blen': 1.33,
                  'charge': -0.7748, 'type': 'NC'},
           "IFIXC,IOMIT,ISYMDU,IPOS": ['CORRECT', 'OMIT', 'DU', 'BEG'],
           "loopList": [["C1'", "C2'"], ['C2', 'N1']],
           "N4": {'torsion': 180.0, 'tree': 'B', 'NC': 17, 'NB': 19, 'NA': 21, 'I': 22, 'angle': 120.1, 'blen': 1.32,
                  'charge': -0.9773, 'type': 'N2'},
           "NAMRES": "D-CYTOSINE - with 5' - phosphate group and 3' - O(minus) group",
           "H4'": {'torsion': -200.0, 'tree': 'E', 'NC': 7, 'NB': 8, 'NA': 11, 'I': 12, 'angle': 109.5, 'blen': 1.09,
                   'charge': 0.1176, 'type': 'H1'},
           "H1'": {'torsion': -240.0, 'tree': 'E', 'NC': 11, 'NB': 13, 'NA': 14, 'I': 15, 'angle': 109.5, 'blen': 1.09,
                   'charge': 0.1963, 'type': 'H2'},
           "O2": {'torsion': 180.0, 'tree': 'E', 'NC': 21, 'NB': 25, 'NA': 26, 'I': 27, 'angle': 122.4, 'blen': 1.24,
                  'charge': -0.6548, 'type': 'O'},
           "atNameList": ['P', 'O1P', 'O2P', "O5'", "C5'", "H5'1", "H5'2", "C4'", "H4'", "O4'", "C1'", "H1'", 'N1',
                          'C6', 'H6', 'C5', 'H5', 'C4', 'N4', 'H41', 'H42', 'N3', 'C2', 'O2', "C3'", "H3'", "C2'",
                          "H2'1", "H2'2", "O3'"],
           "DUMM": [['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.00', '0.00', '0.00', '0.0000'],
                    ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.00', '0.00', '0.00', '0.0000'],
                    ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.00', '90.00', '0.00', '0.0000']],
           "H2'1": {'torsion': 120.0, 'tree': 'E', 'NC': 11, 'NB': 28, 'NA': 30, 'I': 31, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.0718, 'type': 'HC'},
           "N1": {'torsion': -127.7, 'tree': 'S', 'NC': 11, 'NB': 13, 'NA': 14, 'I': 16, 'angle': 108.1, 'blen': 1.49,
                  'charge': -0.0339, 'type': 'N*'},
           "C2'": {'torsion': -86.3, 'tree': 'B', 'NC': 8, 'NB': 11, 'NA': 28, 'I': 30, 'angle': 102.8, 'blen': 1.53,
                   'charge': -0.0854, 'type': 'CT'},
           "H5'2": {'torsion': -60.0, 'tree': 'E', 'NC': 4, 'NB': 7, 'NA': 8, 'I': 10, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.0754, 'type': 'H1'},
           "H5'1": {'torsion': 60.0, 'tree': 'E', 'NC': 4, 'NB': 7, 'NA': 8, 'I': 9, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.0754, 'type': 'H1'},
           "H3'": {'torsion': 30.0, 'tree': 'E', 'NC': 8, 'NB': 11, 'NA': 28, 'I': 29, 'angle': 109.5, 'blen': 1.09,
                   'charge': 0.0985, 'type': 'H1'},
           "C4'": {'torsion': 180.0, 'tree': 'M', 'NC': 4, 'NB': 7, 'NA': 8, 'I': 11, 'angle': 110.0, 'blen': 1.52,
                   'charge': 0.1629, 'type': 'CT'},
           "P": {'torsion': 200.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 119.04, 'blen': 1.6,
                 'charge': 1.1659, 'type': 'P'},
           "C5'": {'torsion': -39.22, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 7, 'I': 8, 'angle': 119.0, 'blen': 1.44,
                   'charge': -0.0069, 'type': 'CT'},
           "O2P": {'torsion': 20.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 6, 'angle': 109.58, 'blen': 1.48,
                   'charge': -0.7761, 'type': 'O2'},
           "C1'": {'torsion': 105.6, 'tree': 'B', 'NC': 8, 'NB': 11, 'NA': 13, 'I': 14, 'angle': 110.04, 'blen': 1.42,
                   'charge': -0.0116, 'type': 'CT'},
           "C3'": {'torsion': -329.11, 'tree': 'M', 'NC': 7, 'NB': 8, 'NA': 11, 'I': 28, 'angle': 115.78, 'blen': 1.53,
                   'charge': 0.0713, 'type': 'CT'},
           "H5": {'torsion': 180.0, 'tree': 'E', 'NC': 16, 'NB': 17, 'NA': 19, 'I': 20, 'angle': 120.0, 'blen': 1.09,
                  'charge': 0.1863, 'type': 'HA'},
           "O1P": {'torsion': 150.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 109.61, 'blen': 1.48,
                   'charge': -0.7761, 'type': 'O2'},
           "CUT": ['0.0'],
           },
    "NAMDBF": 'db94.dat',
    "DAN": {"H2": {'torsion': 180.0, 'tree': 'E', 'NC': 19, 'NB': 23, 'NA': 24, 'I': 25, 'angle': 120.0, 'blen': 1.08,
                   'charge': 0.0598, 'type': 'H5'},
            "C5": {'torsion': 0.0, 'tree': 'S', 'NC': 14, 'NB': 15, 'NA': 17, 'I': 18, 'angle': 104.0, 'blen': 1.39,
                   'charge': 0.0725, 'type': 'CB'},
            "C6": {'torsion': 180.0, 'tree': 'B', 'NC': 15, 'NB': 17, 'NA': 18, 'I': 19, 'angle': 132.42, 'blen': 1.4,
                   'charge': 0.6897, 'type': 'CA'},
            "O3'": {'torsion': -203.47, 'tree': 'M', 'NC': 6, 'NB': 9, 'NA': 28, 'I': 33, 'angle': 116.52, 'blen': 1.42,
                    'charge': -0.6549, 'type': 'OH'},
            "H62": {'torsion': 0.0, 'tree': 'E', 'NC': 18, 'NB': 19, 'NA': 20, 'I': 22, 'angle': 120.0, 'blen': 1.01,
                    'charge': 0.4167, 'type': 'H'},
            "impropTors": [['C8', 'C4', 'N9', "C1'"], ['C6', 'H61', 'N6', 'H62'], ['N7', 'N9', 'C8', 'H8'],
                           ['N1', 'N3', 'C2', 'H2'], ['C5', 'N1', 'C6', 'N6']],
            "C2": {'torsion': 0.0, 'tree': 'B', 'NC': 18, 'NB': 19, 'NA': 23, 'I': 24, 'angle': 118.8, 'blen': 1.33,
                   'charge': 0.5716, 'type': 'CQ'},
            "H61": {'torsion': 180.0, 'tree': 'E', 'NC': 18, 'NB': 19, 'NA': 20, 'I': 21, 'angle': 120.0, 'blen': 1.01,
                    'charge': 0.4167, 'type': 'H'},
            "C2'": {'torsion': -86.3, 'tree': 'B', 'NC': 6, 'NB': 9, 'NA': 28, 'I': 30, 'angle': 102.8, 'blen': 1.53,
                    'charge': -0.0854, 'type': 'CT'},
            "H2'1": {'torsion': 120.0, 'tree': 'E', 'NC': 9, 'NB': 28, 'NA': 30, 'I': 31, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0718, 'type': 'HC'},
            "C8": {'torsion': 81.59, 'tree': 'B', 'NC': 11, 'NB': 12, 'NA': 14, 'I': 15, 'angle': 131.2, 'blen': 1.37,
                   'charge': 0.1607, 'type': 'CK'},
            "O4'": {'torsion': -86.31, 'tree': 'S', 'NC': 5, 'NB': 6, 'NA': 9, 'I': 11, 'angle': 108.86, 'blen': 1.46,
                    'charge': -0.3691, 'type': 'OS'},
            "INTX,KFORM": ['INT', '1'],
            "O5'": {'torsion': -98.89, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 101.43, 'blen': 0.96,
                    'charge': -0.6318, 'type': 'OH'},
            "N7": {'torsion': 177.0, 'tree': 'S', 'NC': 12, 'NB': 14, 'NA': 15, 'I': 17, 'angle': 113.93, 'blen': 1.3,
                   'charge': -0.6175, 'type': 'NB'},
            "H3T": {'torsion': 180.0, 'tree': 'M', 'NC': 9, 'NB': 28, 'NA': 33, 'I': 34, 'angle': 114.97, 'blen': 0.96,
                    'charge': 0.4396, 'type': 'HO'},
            "H2'2": {'torsion': 240.0, 'tree': 'E', 'NC': 9, 'NB': 28, 'NA': 30, 'I': 32, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0718, 'type': 'HC'},
            "IFIXC,IOMIT,ISYMDU,IPOS": ['CORRECT', 'NOMIT', 'DU', 'BEG'],
            "C4": {'torsion': 0.0, 'tree': 'E', 'NC': 23, 'NB': 24, 'NA': 26, 'I': 27, 'angle': 110.8, 'blen': 1.35,
                   'charge': 0.38, 'type': 'CB'},
            "loopList": [["C1'", "C2'"], ['C4', 'C5'], ['C4', 'N9']],
            "H3'": {'torsion': 30.0, 'tree': 'E', 'NC': 6, 'NB': 9, 'NA': 28, 'I': 29, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.0985, 'type': 'H1'},
            "NAMRES": "D-ADENOSINE - with 5' - OH group and 3' - OH group",
            "H8": {'torsion': 0.0, 'tree': 'E', 'NC': 12, 'NB': 14, 'NA': 15, 'I': 16, 'angle': 120.0, 'blen': 1.08,
                   'charge': 0.1877, 'type': 'H5'},
            "H4'": {'torsion': -200.0, 'tree': 'E', 'NC': 5, 'NB': 6, 'NA': 9, 'I': 10, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.1176, 'type': 'H1'},
            "H1'": {'torsion': -240.0, 'tree': 'E', 'NC': 9, 'NB': 11, 'NA': 12, 'I': 13, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.1838, 'type': 'H2'},
            "N6": {'torsion': 0.0, 'tree': 'B', 'NC': 17, 'NB': 18, 'NA': 19, 'I': 20, 'angle': 123.5, 'blen': 1.34,
                   'charge': -0.9123, 'type': 'N2'},
            "atNameList": ['H5T', "O5'", "C5'", "H5'1", "H5'2", "C4'", "H4'", "O4'", "C1'", "H1'", 'N9', 'C8', 'H8',
                           'N7', 'C5', 'C6', 'N6', 'H61', 'H62', 'N1', 'C2', 'H2', 'N3', 'C4', "C3'", "H3'", "C2'",
                           "H2'1", "H2'2", "O3'", 'H3T'],
            "DUMM": [['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.00', '0.00', '0.00', '0.0000'],
                     ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.00', '0.00', '0.00', '0.0000'],
                     ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.00', '90.00', '0.00', '0.0000']],
            "N1": {'torsion': 180.0, 'tree': 'S', 'NC': 17, 'NB': 18, 'NA': 19, 'I': 23, 'angle': 117.43, 'blen': 1.34,
                   'charge': -0.7624, 'type': 'NC'},
            "H5'2": {'torsion': -60.0, 'tree': 'E', 'NC': 4, 'NB': 5, 'NA': 6, 'I': 8, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0754, 'type': 'H1'},
            "H5'1": {'torsion': 60.0, 'tree': 'E', 'NC': 4, 'NB': 5, 'NA': 6, 'I': 7, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0754, 'type': 'H1'},
            "C4'": {'torsion': 180.0, 'tree': 'M', 'NC': 4, 'NB': 5, 'NA': 6, 'I': 9, 'angle': 110.0, 'blen': 1.52,
                    'charge': 0.1629, 'type': 'CT'},
            "N9": {'torsion': -127.7, 'tree': 'S', 'NC': 9, 'NB': 11, 'NA': 12, 'I': 14, 'angle': 109.59, 'blen': 1.52,
                   'charge': -0.0268, 'type': 'N*'},
            "H5T": {'torsion': 180.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 120.0, 'blen': 1.0,
                    'charge': 0.4422, 'type': 'HO'},
            "C5'": {'torsion': -39.22, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 5, 'I': 6, 'angle': 119.0, 'blen': 1.44,
                    'charge': -0.0069, 'type': 'CT'},
            "C1'": {'torsion': 105.6, 'tree': 'B', 'NC': 6, 'NB': 9, 'NA': 11, 'I': 12, 'angle': 110.04, 'blen': 1.42,
                    'charge': 0.0431, 'type': 'CT'},
            "C3'": {'torsion': -329.11, 'tree': 'M', 'NC': 5, 'NB': 6, 'NA': 9, 'I': 28, 'angle': 115.78, 'blen': 1.53,
                    'charge': 0.0713, 'type': 'CT'},
            "N3": {'torsion': 0.0, 'tree': 'S', 'NC': 19, 'NB': 23, 'NA': 24, 'I': 26, 'angle': 129.17, 'blen': 1.32,
                   'charge': -0.7417, 'type': 'NC'},
            "CUT": ['0.0'],
            },
    "DG": {"C4": {'torsion': 0.0, 'tree': 'E', 'NC': 23, 'NB': 25, 'NA': 29, 'I': 30, 'angle': 112.2, 'blen': 1.36,
                  'charge': 0.1814, 'type': 'CB'},
           "C5": {'torsion': 0.0, 'tree': 'S', 'NC': 16, 'NB': 17, 'NA': 19, 'I': 20, 'angle': 103.9, 'blen': 1.39,
                  'charge': 0.1991, 'type': 'CB'},
           "C6": {'torsion': 180.0, 'tree': 'B', 'NC': 17, 'NB': 19, 'NA': 20, 'I': 21, 'angle': 130.4, 'blen': 1.42,
                  'charge': 0.4918, 'type': 'C'},
           "O3'": {'torsion': -203.47, 'tree': 'M', 'NC': 8, 'NB': 11, 'NA': 31, 'I': 36, 'angle': 116.52, 'blen': 1.42,
                   'charge': -0.5232, 'type': 'OS'},
           "impropTors": [['C8', 'C4', 'N9', "C1'"], ['C5', 'N1', 'C6', 'O6'], ['C6', 'C2', 'N1', 'H1'],
                          ['C2', 'H21', 'N2', 'H22'], ['N7', 'N9', 'C8', 'H8'], ['N1', 'N3', 'C2', 'N2']],
           "C2": {'torsion': -0.1, 'tree': 'B', 'NC': 20, 'NB': 21, 'NA': 23, 'I': 25, 'angle': 125.24, 'blen': 1.38,
                  'charge': 0.7432, 'type': 'CA'},
           "N3": {'torsion': 0.0, 'tree': 'S', 'NC': 21, 'NB': 23, 'NA': 25, 'I': 29, 'angle': 123.3, 'blen': 1.33,
                  'charge': -0.6636, 'type': 'NC'},
           "P": {'torsion': 200.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 119.04, 'blen': 1.6,
                 'charge': 1.1659, 'type': 'P'},
           "H1": {'torsion': 179.9, 'tree': 'E', 'NC': 20, 'NB': 21, 'NA': 23, 'I': 24, 'angle': 117.36, 'blen': 1.0,
                  'charge': 0.352, 'type': 'H'},
           "C8": {'torsion': 81.59, 'tree': 'B', 'NC': 13, 'NB': 14, 'NA': 16, 'I': 17, 'angle': 129.2, 'blen': 1.38,
                  'charge': 0.0736, 'type': 'CK'},
           "O4'": {'torsion': -86.31, 'tree': 'S', 'NC': 7, 'NB': 8, 'NA': 11, 'I': 13, 'angle': 108.86, 'blen': 1.46,
                   'charge': -0.3691, 'type': 'OS'},
           "INTX,KFORM": ['INT', '1'],
           "O5'": {'torsion': -98.89, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 7, 'angle': 101.43, 'blen': 1.6,
                   'charge': -0.4954, 'type': 'OS'},
           "N7": {'torsion': -179.9, 'tree': 'S', 'NC': 14, 'NB': 16, 'NA': 17, 'I': 19, 'angle': 114.0, 'blen': 1.31,
                  'charge': -0.5725, 'type': 'NB'},
           "H2'2": {'torsion': 240.0, 'tree': 'E', 'NC': 11, 'NB': 31, 'NA': 33, 'I': 35, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.0718, 'type': 'HC'},
           "IFIXC,IOMIT,ISYMDU,IPOS": ['CORRECT', 'OMIT', 'DU', 'BEG'],
           "N1": {'torsion': 180.0, 'tree': 'B', 'NC': 19, 'NB': 20, 'NA': 21, 'I': 23, 'angle': 111.38, 'blen': 1.4,
                  'charge': -0.5053, 'type': 'NA'},
           "loopList": [["C1'", "C2'"], ['C4', 'C5'], ['C4', 'N9']],
           "H21": {'torsion': -0.82, 'tree': 'E', 'NC': 23, 'NB': 25, 'NA': 26, 'I': 27, 'angle': 127.0, 'blen': 1.01,
                   'charge': 0.4235, 'type': 'H'},
           "NAMRES": "D-GUANOSINE - with 5' - phosphate group and 3' - O(minus) group",
           "H8": {'torsion': 0.0, 'tree': 'E', 'NC': 14, 'NB': 16, 'NA': 17, 'I': 18, 'angle': 120.0, 'blen': 1.08,
                  'charge': 0.1997, 'type': 'H5'},
           "H4'": {'torsion': -200.0, 'tree': 'E', 'NC': 7, 'NB': 8, 'NA': 11, 'I': 12, 'angle': 109.5, 'blen': 1.09,
                   'charge': 0.1176, 'type': 'H1'},
           "H1'": {'torsion': -240.0, 'tree': 'E', 'NC': 11, 'NB': 13, 'NA': 14, 'I': 15, 'angle': 109.5, 'blen': 1.09,
                   'charge': 0.1746, 'type': 'H2'},
           "atNameList": ['P', 'O1P', 'O2P', "O5'", "C5'", "H5'1", "H5'2", "C4'", "H4'", "O4'", "C1'", "H1'", 'N9',
                          'C8', 'H8', 'N7', 'C5', 'C6', 'O6', 'N1', 'H1', 'C2', 'N2', 'H21', 'H22', 'N3', 'C4', "C3'",
                          "H3'", "C2'", "H2'1", "H2'2", "O3'"],
           "DUMM": [['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.00', '0.00', '0.00', '0.0000'],
                    ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.00', '0.00', '0.00', '0.0000'],
                    ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.00', '90.00', '0.00', '0.0000']],
           "N2": {'torsion': 180.0, 'tree': 'B', 'NC': 21, 'NB': 23, 'NA': 25, 'I': 26, 'angle': 116.02, 'blen': 1.34,
                  'charge': -0.923, 'type': 'N2'},
           "O6": {'torsion': 0.0, 'tree': 'E', 'NC': 19, 'NB': 20, 'NA': 21, 'I': 22, 'angle': 128.8, 'blen': 1.23,
                  'charge': -0.5699, 'type': 'O'},
           "C2'": {'torsion': -86.3, 'tree': 'B', 'NC': 8, 'NB': 11, 'NA': 31, 'I': 33, 'angle': 102.8, 'blen': 1.53,
                   'charge': -0.0854, 'type': 'CT'},
           "H5'2": {'torsion': -60.0, 'tree': 'E', 'NC': 4, 'NB': 7, 'NA': 8, 'I': 10, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.0754, 'type': 'H1'},
           "H5'1": {'torsion': 60.0, 'tree': 'E', 'NC': 4, 'NB': 7, 'NA': 8, 'I': 9, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.0754, 'type': 'H1'},
           "H3'": {'torsion': 30.0, 'tree': 'E', 'NC': 8, 'NB': 11, 'NA': 31, 'I': 32, 'angle': 109.5, 'blen': 1.09,
                   'charge': 0.0985, 'type': 'H1'},
           "C4'": {'torsion': 180.0, 'tree': 'M', 'NC': 4, 'NB': 7, 'NA': 8, 'I': 11, 'angle': 110.0, 'blen': 1.52,
                   'charge': 0.1629, 'type': 'CT'},
           "H2'1": {'torsion': 120.0, 'tree': 'E', 'NC': 11, 'NB': 31, 'NA': 33, 'I': 34, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.0718, 'type': 'HC'},
           "N9": {'torsion': -127.7, 'tree': 'S', 'NC': 11, 'NB': 13, 'NA': 14, 'I': 16, 'angle': 108.06, 'blen': 1.49,
                  'charge': 0.0577, 'type': 'N*'},
           "C5'": {'torsion': -39.22, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 7, 'I': 8, 'angle': 119.0, 'blen': 1.44,
                   'charge': -0.0069, 'type': 'CT'},
           "H22": {'torsion': -179.44, 'tree': 'E', 'NC': 23, 'NB': 25, 'NA': 26, 'I': 28, 'angle': 116.53,
                   'blen': 1.01, 'charge': 0.4235, 'type': 'H'},
           "O2P": {'torsion': 20.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 6, 'angle': 109.58, 'blen': 1.48,
                   'charge': -0.7761, 'type': 'O2'},
           "C1'": {'torsion': 105.6, 'tree': 'B', 'NC': 8, 'NB': 11, 'NA': 13, 'I': 14, 'angle': 110.04, 'blen': 1.42,
                   'charge': 0.0358, 'type': 'CT'},
           "C3'": {'torsion': -329.11, 'tree': 'M', 'NC': 7, 'NB': 8, 'NA': 11, 'I': 31, 'angle': 115.78, 'blen': 1.53,
                   'charge': 0.0713, 'type': 'CT'},
           "O1P": {'torsion': 150.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 109.61, 'blen': 1.48,
                   'charge': -0.7761, 'type': 'O2'},
           "CUT": ['0.0'],
           },
    "DTN": {"H71": {'torsion': 60.0, 'tree': 'E', 'NC': 15, 'NB': 17, 'NA': 18, 'I': 19, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.077, 'type': 'HC'},
            "C5": {'torsion': 177.3, 'tree': 'B', 'NC': 12, 'NB': 14, 'NA': 15, 'I': 17, 'angle': 121.22, 'blen': 1.34,
                   'charge': 0.0025, 'type': 'CM'},
            "C6": {'torsion': 81.59, 'tree': 'B', 'NC': 11, 'NB': 12, 'NA': 14, 'I': 15, 'angle': 123.04, 'blen': 1.37,
                   'charge': -0.2209, 'type': 'CM'},
            "C7": {'torsion': 180.0, 'tree': '3', 'NC': 14, 'NB': 15, 'NA': 17, 'I': 18, 'angle': 121.63, 'blen': 1.5,
                   'charge': -0.2269, 'type': 'CT'},
            "H6": {'torsion': 0.0, 'tree': 'E', 'NC': 12, 'NB': 14, 'NA': 15, 'I': 16, 'angle': 120.0, 'blen': 1.08,
                   'charge': 0.2607, 'type': 'H4'},
            "O3'": {'torsion': -203.47, 'tree': 'M', 'NC': 6, 'NB': 9, 'NA': 28, 'I': 33, 'angle': 116.52, 'blen': 1.42,
                    'charge': -0.6549, 'type': 'OH'},
            "C2": {'torsion': 0.0, 'tree': 'S', 'NC': 17, 'NB': 22, 'NA': 24, 'I': 26, 'angle': 126.46, 'blen': 1.38,
                   'charge': 0.5677, 'type': 'C'},
            "N3": {'torsion': 0.0, 'tree': 'B', 'NC': 15, 'NB': 17, 'NA': 22, 'I': 24, 'angle': 114.07, 'blen': 1.38,
                   'charge': -0.434, 'type': 'NA'},
            "C2'": {'torsion': -86.3, 'tree': 'B', 'NC': 6, 'NB': 9, 'NA': 28, 'I': 30, 'angle': 102.8, 'blen': 1.53,
                    'charge': -0.0854, 'type': 'CT'},
            "H2'1": {'torsion': 120.0, 'tree': 'E', 'NC': 9, 'NB': 28, 'NA': 30, 'I': 31, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0718, 'type': 'HC'},
            "H2'2": {'torsion': 240.0, 'tree': 'E', 'NC': 9, 'NB': 28, 'NA': 30, 'I': 32, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0718, 'type': 'HC'},
            "O4'": {'torsion': -86.31, 'tree': 'S', 'NC': 5, 'NB': 6, 'NA': 9, 'I': 11, 'angle': 108.86, 'blen': 1.46,
                    'charge': -0.3691, 'type': 'OS'},
            "INTX,KFORM": ['INT', '1'],
            "O5'": {'torsion': -98.89, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 101.43, 'blen': 0.96,
                    'charge': -0.6318, 'type': 'OH'},
            "O4": {'torsion': 180.0, 'tree': 'E', 'NC': 15, 'NB': 17, 'NA': 22, 'I': 23, 'angle': 125.35, 'blen': 1.23,
                   'charge': -0.5563, 'type': 'O'},
            "H3T": {'torsion': 180.0, 'tree': 'M', 'NC': 9, 'NB': 28, 'NA': 33, 'I': 34, 'angle': 114.97, 'blen': 0.96,
                    'charge': 0.4396, 'type': 'HO'},
            "H3": {'torsion': 180.0, 'tree': 'E', 'NC': 17, 'NB': 22, 'NA': 24, 'I': 25, 'angle': 116.77, 'blen': 1.09,
                   'charge': 0.342, 'type': 'H'},
            "IFIXC,IOMIT,ISYMDU,IPOS": ['CORRECT', 'NOMIT', 'DU', 'BEG'],
            "C4": {'torsion': 0.0, 'tree': 'B', 'NC': 14, 'NB': 15, 'NA': 17, 'I': 22, 'angle': 120.78, 'blen': 1.44,
                   'charge': 0.5194, 'type': 'C'},
            "H73": {'torsion': 300.0, 'tree': 'E', 'NC': 15, 'NB': 17, 'NA': 18, 'I': 21, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.077, 'type': 'HC'},
            "H3'": {'torsion': 30.0, 'tree': 'E', 'NC': 6, 'NB': 9, 'NA': 28, 'I': 29, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.0985, 'type': 'H1'},
            "NAMRES": "D-THYMINE - with 5' - OH group and 3' - OH group",
            "H4'": {'torsion': -200.0, 'tree': 'E', 'NC': 5, 'NB': 6, 'NA': 9, 'I': 10, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.1176, 'type': 'H1'},
            "H1'": {'torsion': -240.0, 'tree': 'E', 'NC': 9, 'NB': 11, 'NA': 12, 'I': 13, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.1804, 'type': 'H2'},
            "O2": {'torsion': 180.0, 'tree': 'E', 'NC': 22, 'NB': 24, 'NA': 26, 'I': 27, 'angle': 121.7, 'blen': 1.22,
                   'charge': -0.5881, 'type': 'O'},
            "atNameList": ['H5T', "O5'", "C5'", "H5'1", "H5'2", "C4'", "H4'", "O4'", "C1'", "H1'", 'N1', 'C6', 'H6',
                           'C5', 'C7', 'H71', 'H72', 'H73', 'C4', 'O4', 'N3', 'H3', 'C2', 'O2', "C3'", "H3'", "C2'",
                           "H2'1", "H2'2", "O3'", 'H3T'],
            "DUMM": [['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.00', '0.00', '0.00', '0.0000'],
                     ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.00', '0.00', '0.00', '0.0000'],
                     ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.00', '90.00', '0.00', '0.0000']],
            "N1": {'torsion': -127.7, 'tree': 'S', 'NC': 9, 'NB': 11, 'NA': 12, 'I': 14, 'angle': 109.59, 'blen': 1.53,
                   'charge': -0.0239, 'type': 'N*'},
            "H5'2": {'torsion': -60.0, 'tree': 'E', 'NC': 4, 'NB': 5, 'NA': 6, 'I': 8, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0754, 'type': 'H1'},
            "H5'1": {'torsion': 60.0, 'tree': 'E', 'NC': 4, 'NB': 5, 'NA': 6, 'I': 7, 'angle': 109.5, 'blen': 1.09,
                     'charge': 0.0754, 'type': 'H1'},
            "C4'": {'torsion': -180.0, 'tree': 'M', 'NC': 4, 'NB': 5, 'NA': 6, 'I': 9, 'angle': 110.0, 'blen': 1.52,
                    'charge': 0.1629, 'type': 'CT'},
            "H72": {'torsion': 180.0, 'tree': 'E', 'NC': 15, 'NB': 17, 'NA': 18, 'I': 20, 'angle': 109.5, 'blen': 1.09,
                    'charge': 0.077, 'type': 'HC'},
            "H5T": {'torsion': 180.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 120.0, 'blen': 1.0,
                    'charge': 0.4422, 'type': 'HO'},
            "C5'": {'torsion': -39.22, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 5, 'I': 6, 'angle': 119.0, 'blen': 1.44,
                    'charge': -0.0069, 'type': 'CT'},
            "C1'": {'torsion': 105.6, 'tree': 'B', 'NC': 6, 'NB': 9, 'NA': 11, 'I': 12, 'angle': 110.04, 'blen': 1.42,
                    'charge': 0.068, 'type': 'CT'},
            "C3'": {'torsion': -329.11, 'tree': 'M', 'NC': 5, 'NB': 6, 'NA': 9, 'I': 28, 'angle': 115.78, 'blen': 1.53,
                    'charge': 0.0713, 'type': 'CT'},
            "loopList": [["C1'", "C2'"], ['C2', 'N1']],
            "CUT": ['0.0'],
            "impropTors": [['C6', 'C2', 'N1', "C1'"], ['C4', 'C6', 'C5', 'C7'], ['N1', 'N3', 'C2', 'O2'],
                           ['C5', 'N3', 'C4', 'O4'], ['C2', 'C4', 'N3', 'H3'], ['N1', 'C5', 'C6', 'H6']],
            },
    "filename": 'all_nuc94.in',
}
